28
TS_CCl-PdL2 (VL_PR3, r0 = 1.3, θ = 120), G = -5219.801283811212
Pd	   0.557988526104	  -0.893608007263	  -2.302516442482
P 	  -0.607800147976	   0.503051903441	  -0.578781936212
Cl	  -1.743271770858	   1.156190132883	  -1.333496903926
Cl	  -1.111767427024	  -0.492261333454	   0.441096075219
Cl	   0.288024728761	   1.538551262359	   0.062616722849
P 	   2.798510045859	  -0.053360219325	  -2.454059926401
Cl	   3.334841284458	  -0.389319958270	  -3.823252100630
Cl	   3.520299957062	  -0.785894583674	  -1.347529979838
Cl	   2.753014175941	   1.437101818810	  -2.209525103607
C 	   0.677277907077	  -2.486061327260	  -3.470244949307
Cl	   1.263310596765	  -1.849122981172	  -5.663462446860
C 	  -0.743871264360	  -2.573228692763	  -3.367297652990
C 	  -1.360144007928	  -3.771157673787	  -2.960334061612
C 	  -0.570019266865	  -4.860477542971	  -2.659608436834
C 	   0.829746153368	  -4.822034477302	  -2.791734837279
C 	   1.441240079779	  -3.657516647993	  -3.204169716750
H 	  -1.380071858204	  -1.761737211709	  -3.737323146540
H 	  -2.447865133442	  -3.849545073106	  -2.899428984420
H 	   1.419518142237	  -5.707456620173	  -2.546668829759
H 	   2.528118669773	  -3.630287410644	  -3.310445225096
O 	  -1.196202699658	  -6.061812538127	  -2.259373904093
S 	  -1.174946745832	  -6.498140071786	  -0.718493400484
O 	  -1.753139683335	  -7.814519346891	  -0.675716610629
O 	   0.080901514465	  -6.175798653445	  -0.086550403436
C 	  -2.436879343212	  -5.336269272802	   0.018388237074
F 	  -1.934118463165	  -4.121580184308	   0.128218165371
F 	  -3.520944235372	  -5.302321944810	  -0.731988691358
F 	  -2.746156754508	  -5.791389911333	   1.218626112382
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.3, θ = 130), G = -5219.799723347021
Pd	   0.564450996078	  -0.883282774574	  -2.287230688507
P 	  -0.610276364126	   0.567265015648	  -0.600774616387
Cl	  -1.706385157930	   1.239508459732	  -1.395855288672
Cl	  -1.167123980797	  -0.387998940223	   0.429603452413
Cl	   0.303523680215	   1.589771647385	   0.036399357450
P 	   2.817161855728	  -0.055732254114	  -2.452299400962
Cl	   3.355649371456	  -0.416764170874	  -3.814183137202
Cl	   3.533411953363	  -0.769378200052	  -1.329964859731
Cl	   2.775093150684	   1.438956311089	  -2.233906998438
C 	   0.671655077587	  -2.481709981524	  -3.450284985864
Cl	   1.234889899787	  -1.837760651094	  -5.634983258819
C 	  -0.748990201397	  -2.566015433151	  -3.336936408406
C 	  -1.365780942203	  -3.766301430896	  -2.937278749807
C 	  -0.576999446182	  -4.861409803599	  -2.654442032086
C 	   0.822006004501	  -4.824586613445	  -2.793619881739
C 	   1.433865221262	  -3.657642879529	  -3.197490640727
H 	  -1.385550402796	  -1.751447917275	  -3.699489098137
H 	  -2.453355258205	  -3.842916575938	  -2.871096943092
H 	   1.410859748339	  -5.714349755697	  -2.562591246137
H 	   2.519704116244	  -3.634254703288	  -3.311691342051
O 	  -1.203242117439	  -6.067952540131	  -2.270448173170
S 	  -1.172520986234	  -6.532464714400	  -0.738126691203
O 	  -1.747366597126	  -7.850766939203	  -0.716080620599
O 	   0.085544169375	  -6.218407342038	  -0.106417900062
C 	  -2.433720168394	  -5.386606023016	   0.022753364195
F 	  -1.932997557875	  -4.172733660513	   0.149415063359
F 	  -3.520809978200	  -5.343391302005	  -0.722808833186
F 	  -2.737103105745	  -5.861633394220	   1.216772180296
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.3, θ = 140), G = -5219.797579727201
Pd	   0.565273689602	  -0.846776769488	  -2.278234425094
P 	  -0.675536352607	   0.686070026916	  -0.702646864859
Cl	  -1.729790226097	   1.314033314511	  -1.585683151525
Cl	  -1.281955281615	  -0.203306857693	   0.358049290066
Cl	   0.216144596894	   1.742984376941	  -0.090619914636
P 	   2.866185288719	  -0.123404149798	  -2.406519016127
Cl	   3.332019988671	  -0.284659381618	  -3.831937315358
Cl	   3.583109748888	  -1.037555486573	  -1.441364470692
Cl	   2.913166953455	   1.316947610091	  -1.950999613175
C 	   0.670133832830	  -2.465632791775	  -3.421939989377
Cl	   1.186046741406	  -1.794657602005	  -5.597311669659
C 	  -0.750316534037	  -2.545240176550	  -3.296840382521
C 	  -1.370038652295	  -3.744157498391	  -2.899350460056
C 	  -0.585291555084	  -4.848722395344	  -2.640734173422
C 	   0.811023426549	  -4.819078794629	  -2.799812292004
C 	   1.425929769165	  -3.650681682394	  -3.194482653402
H 	  -1.385729156022	  -1.726556634019	  -3.652280860676
H 	  -2.457241127566	  -3.814833311750	  -2.821864076204
H 	   1.396548132780	  -5.716862746785	  -2.592854423498
H 	   2.509100705052	  -3.639003657595	  -3.326507126185
O 	  -1.213698632831	  -6.058667761328	  -2.271961584196
S 	  -1.148789979357	  -6.567672632983	  -0.755105026090
O 	  -1.710136779584	  -7.891970357057	  -0.760650904569
O 	   0.117395016919	  -6.258777622974	  -0.137252137847
C 	  -2.407771140681	  -5.457495405568	   0.057037745215
F 	  -1.920503646212	  -4.239428340884	   0.196430253397
F 	  -3.510536398681	  -5.415117352598	  -0.665157592099
F 	  -2.679149448382	  -5.959782485522	   1.247534456914
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.3, θ = 150), G = -5219.794051500287
Pd	   0.563110988131	  -0.825985915935	  -2.255370305926
P 	  -0.758327475318	   0.825540407904	  -0.848240258708
Cl	  -1.679376797302	   1.461161535821	  -1.864730979351
Cl	  -1.519069750363	   0.021756129302	   0.180743468711
Cl	   0.123131905413	   1.864758729883	  -0.192536179873
P 	   2.901926691464	  -0.171919561898	  -2.307595886095
Cl	   3.398269543254	  -0.301926074355	  -3.725911264502
Cl	   3.574589804184	  -1.125468674533	  -1.348901803652
Cl	   2.966606656891	   1.254254271271	  -1.810648007953
C 	   0.661464700470	  -2.463934016150	  -3.376214409723
Cl	   1.172442414186	  -1.731752780659	  -5.515921999005
C 	  -0.759713239571	  -2.525854874350	  -3.251514909028
C 	  -1.396507253829	  -3.720587373550	  -2.870225747752
C 	  -0.629043439569	  -4.844711523581	  -2.645524952293
C 	   0.765700788453	  -4.835225497330	  -2.817880826233
C 	   1.397981481585	  -3.666550755654	  -3.183287321998
H 	  -1.383637423928	  -1.693343746272	  -3.595226141499
H 	  -2.484115630867	  -3.776403143804	  -2.785888671412
H 	   1.337084339883	  -5.748661854868	  -2.644518138327
H 	   2.479186628280	  -3.672560694010	  -3.324907712929
O 	  -1.281781681830	  -6.051612679542	  -2.309651668299
S 	  -1.157966902659	  -6.654045754052	  -0.832290108288
O 	  -1.815004327465	  -7.932914535851	  -0.875182151927
O 	   0.165216648519	  -6.475492268534	  -0.285859825014
C 	  -2.272672054426	  -5.509967798162	   0.129303164308
F 	  -1.694601009883	  -4.334650826328	   0.287283109860
F 	  -3.419776275301	  -5.359397648345	  -0.504440152931
F 	  -2.489526348499	  -6.054509643304	   1.312081302158
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.3, θ = 160), G = -5219.788655309409
Pd	   0.586886308874	  -0.815074260582	  -2.231073085930
P 	  -0.797140317442	   0.930056329569	  -0.960043360930
Cl	  -1.459139661757	   1.702242325240	  -2.078609440272
Cl	  -1.802539432852	   0.179063181446	  -0.118332715337
Cl	   0.066703454858	   1.836628473612	  -0.112209868728
P 	   2.937340580577	  -0.143413859995	  -2.334051565875
Cl	   3.199534772945	   0.299159785986	  -3.752385126428
Cl	   3.757510959887	  -1.341514949954	  -1.920910197696
Cl	   3.074191857942	   0.992872674529	  -1.346344671531
C 	   0.681614757336	  -2.481273223995	  -3.310081121345
Cl	   1.226430973161	  -1.755703278050	  -5.444559092189
C 	  -0.740577308152	  -2.535495805796	  -3.205704253846
C 	  -1.391212057803	  -3.725138561730	  -2.834207481470
C 	  -0.635454932743	  -4.857018533705	  -2.605785555089
C 	   0.760226704499	  -4.856111261553	  -2.759523032226
C 	   1.405101305283	  -3.689256109931	  -3.110182511982
H 	  -1.354287396139	  -1.697506074078	  -3.554053837529
H 	  -2.480159402955	  -3.774170588611	  -2.765155106024
H 	   1.323525639537	  -5.774745128996	  -2.588141232103
H 	   2.486184005865	  -3.709884455974	  -3.243278544441
O 	  -1.304405108904	  -6.061993213679	  -2.297245589700
S 	  -1.185637439662	  -6.710228155541	  -0.839154950375
O 	  -1.867604765130	  -7.974282371939	  -0.917666102851
O 	   0.142757028738	  -6.574003985777	  -0.293585266992
C 	  -2.274210281085	  -5.572607866076	   0.157659441651
F 	  -1.679079824571	  -4.408084545989	   0.330987449935
F 	  -3.425459696712	  -5.395486672017	  -0.461363132443
F 	  -2.485507743688	  -6.137036433440	   1.331941574220
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.3, θ = 170), G = -5219.780463340585
Pd	   0.592986327032	  -0.782210425403	  -2.224320814802
P 	  -0.859110163362	   1.044932027466	  -1.083026777352
Cl	  -1.493378615349	   1.733367778604	  -2.270101117143
Cl	  -1.882240062837	   0.365009999795	  -0.203443372575
Cl	  -0.006257948319	   2.011366314326	  -0.291465064139
P 	   3.018553084507	  -0.257644649337	  -2.184158810495
Cl	   3.497214842656	  -0.164843346050	  -3.611693243832
Cl	   3.679028759150	  -1.361960533851	  -1.394540334501
Cl	   3.108443605804	   1.070097251929	  -1.466323115737
C 	   0.645615332885	  -2.453700140295	  -3.298366584999
Cl	   1.108493418693	  -1.589438848355	  -5.371391490028
C 	  -0.772487058462	  -2.507754378847	  -3.156690520684
C 	  -1.414719994014	  -3.701484912803	  -2.788837995148
C 	  -0.657543976970	  -4.843639220934	  -2.618760169624
C 	   0.728976983032	  -4.845289044771	  -2.832067272600
C 	   1.367670067957	  -3.671008090930	  -3.171955619931
H 	  -1.391161337899	  -1.659046455143	  -3.466847652129
H 	  -2.500564350329	  -3.747995033930	  -2.682384135149
H 	   1.291042089403	  -5.773070249313	  -2.714470299405
H 	   2.440334769102	  -3.690757052774	  -3.352675464721
O 	  -1.319672157208	  -6.053786902497	  -2.317862850832
S 	  -1.149839798552	  -6.740568944017	  -0.881877819861
O 	  -1.821283082309	  -8.009347193118	  -0.974453895227
O 	   0.193020382399	  -6.604207247192	  -0.373674798446
C 	  -2.220795114707	  -5.641548329415	   0.174818023238
F 	  -1.635111657123	  -4.473912531008	   0.357932106453
F 	  -3.391964300695	  -5.465300695490	  -0.405514056180
F 	  -2.389657064594	  -6.236265713527	   1.341094768155
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.3, θ = 180), G = -5219.770073303323
Pd	   0.634508922445	  -0.743482846274	  -2.211235614687
P 	  -0.931327921632	   1.175343977040	  -1.252970920897
Cl	  -1.522782407553	   1.782863610288	  -2.504446925665
Cl	  -1.983813453051	   0.572246420593	  -0.352495945819
Cl	  -0.089614747255	   2.190803894530	  -0.511556173671
P 	   3.129004996059	  -0.336601313908	  -2.078048302693
Cl	   3.661552345573	  -0.240665804165	  -3.486429366298
Cl	   3.736559050056	  -1.460734734575	  -1.274009619920
Cl	   3.218575566635	   0.983154164503	  -1.345193024352
C 	   0.619409767860	  -2.433607587122	  -3.253725159805
Cl	   1.048491360923	  -1.466351520594	  -5.253509696126
C 	  -0.793554138441	  -2.490049246119	  -3.085914094303
C 	  -1.428867381993	  -3.687056370808	  -2.724763494825
C 	  -0.672023419814	  -4.836791292341	  -2.602302379520
C 	   0.705593071730	  -4.836512086894	  -2.856490413427
C 	   1.339365303812	  -3.654435651585	  -3.183736844178
H 	  -1.413147727331	  -1.630341675704	  -3.357750182340
H 	  -2.511500937559	  -3.733520390080	  -2.592380533951
H 	   1.265535439990	  -5.770219606262	  -2.787454784796
H 	   2.402735061676	  -3.672600935648	  -3.405402790007
O 	  -1.331963325529	  -6.052764612524	  -2.323959288303
S 	  -1.138276815013	  -6.785712016798	  -0.913432571694
O 	  -1.798264947587	  -8.057498583475	  -1.041030788150
O 	   0.209059375263	  -6.651543407565	  -0.417257940613
C 	  -2.208981813479	  -5.732427918691	   0.188187392620
F 	  -1.640558701319	  -4.559601181052	   0.390006493068
F 	  -3.392799041482	  -5.563486076657	  -0.367951973254
F 	  -2.347320503103	  -6.358413774968	   1.342196565965
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.3, θ = 190), G = -5219.759715094412
Pd	   0.924989631830	  -0.591835886538	  -2.171680581043
P 	  -0.958442307304	   1.307334018384	  -1.925390174841
Cl	  -1.631296626138	   1.572093987096	  -3.251241609670
Cl	  -1.934425415341	   1.020068224536	  -0.808236565966
Cl	  -0.038156997797	   2.448803537199	  -1.548030956602
P 	   3.493131803021	  -0.787384318588	  -1.655815706828
Cl	   4.245969701193	  -0.492940303666	  -2.932617615222
Cl	   3.936456786530	  -2.065065234895	  -0.984515873452
Cl	   3.577837186784	   0.390709026901	  -0.708976820090
C 	   0.234293986082	  -2.180110586596	  -3.187872324079
Cl	   0.424193287703	  -1.012142121944	  -4.915719993839
C 	  -1.126959787298	  -2.417572879003	  -2.863593807183
C 	  -1.577546663422	  -3.687932464290	  -2.526237569357
C 	  -0.694027043870	  -4.759188097547	  -2.561324304911
C 	   0.630171811423	  -4.583019291931	  -2.952480449526
C 	   1.086098443904	  -3.312826655097	  -3.276529420197
H 	  -1.838070823033	  -1.597533066809	  -2.901503611191
H 	  -2.623683290520	  -3.855039338940	  -2.263762792033
H 	   1.292175974569	  -5.447083137133	  -3.023987629326
H 	   2.101535242324	  -3.183527265982	  -3.645330173732
O 	  -1.191338284009	  -6.053359986545	  -2.308372797396
S 	  -0.912953784824	  -6.782659633003	  -0.909469599593
O 	  -1.320886617323	  -8.150186939922	  -1.091525326550
O 	   0.368034655586	  -6.412084101996	  -0.362439668283
C 	  -2.199696307709	  -5.988080841374	   0.180476475194
F 	  -1.856985077629	  -4.745017759270	   0.456196240378
F 	  -3.372381174138	  -6.001758927329	  -0.423612458019
F 	  -2.272445330705	  -6.682666522603	   1.300536735731
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.3, θ = 200), G = -5219.747813165310
Pd	   0.965186418287	  -0.596506497482	  -2.159196117880
P 	  -1.013344109138	   1.413333044151	  -2.050835672816
Cl	  -1.598568895238	   1.635487530303	  -3.425208428689
Cl	  -2.059065302027	   1.176264600038	  -0.986301598712
Cl	  -0.100852417183	   2.556070710827	  -1.658781496226
P 	   3.577360165597	  -0.742264394414	  -1.578105598324
Cl	   4.339959862455	  -0.499557889482	  -2.860015620178
Cl	   4.017058000308	  -1.990128184101	  -0.850629673770
Cl	   3.648906711491	   0.474443545232	  -0.680561742287
C 	   0.253290316461	  -2.185183252058	  -3.170505240292
Cl	   0.412979842742	  -1.033572017739	  -4.860741394247
C 	  -1.093799421153	  -2.389815590888	  -2.768844692317
C 	  -1.564416403904	  -3.651712177992	  -2.426755596991
C 	  -0.720894238849	  -4.748666092621	  -2.533927354917
C 	   0.590844074214	  -4.602633625525	  -2.977950811804
C 	   1.070864819545	  -3.340971694343	  -3.298640724062
H 	  -1.779951496124	  -1.549195605824	  -2.757294551088
H 	  -2.599596264833	  -3.794157160610	  -2.112477572232
H 	   1.219058561447	  -5.485512005881	  -3.101819867881
H 	   2.070707018102	  -3.234562143461	  -3.714263880603
O 	  -1.257271729688	  -6.032976402447	  -2.314793730755
S 	  -0.949134880707	  -6.843713955498	  -0.968633888883
O 	  -1.384708075443	  -8.192907074648	  -1.213037082181
O 	   0.353134470276	  -6.520690290209	  -0.442826270733
C 	  -2.190522925128	  -6.093817293386	   0.201038636683
F 	  -1.831002355654	  -4.864872896757	   0.516738496692
F 	  -3.383888468345	  -6.076459689740	  -0.360572519976
F 	  -2.226740297601	  -6.835730062290	   1.291885616831
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.4, θ = 120), G = -5220.600900240561
Pd	   0.410515010610	  -0.699445130930	  -2.606104762018
P 	  -0.585950632275	   1.391572161299	  -1.678413003153
Cl	  -1.579675993170	   1.941258174414	  -2.755488617939
Cl	  -1.367683917165	   1.010882011291	  -0.376941011051
Cl	   0.497487526435	   2.474036631385	  -1.355432494943
P 	   2.489107178250	  -1.040941122328	  -1.338523349261
Cl	   3.538218371965	  -0.029311679615	  -1.908818170431
Cl	   3.027112491574	  -2.505274759795	  -1.439726887283
Cl	   2.160502826586	  -0.686806161450	   0.150133482155
C 	   0.296209089986	  -2.419710537748	  -3.645171495785
Cl	   0.465431948466	  -1.167578141287	  -5.281073926077
C 	  -1.085592741418	  -2.602266572919	  -3.329313411592
C 	  -1.526025779322	  -3.818050109262	  -2.810119155258
C 	  -0.635706649377	  -4.878727192563	  -2.723157202392
C 	   0.672824298640	  -4.778432116668	  -3.211456671649
C 	   1.133947039380	  -3.568552476065	  -3.694946659882
H 	  -1.808903384292	  -1.805682845736	  -3.523420365053
H 	  -2.567660150608	  -3.950228802195	  -2.510318879930
H 	   1.326222982885	  -5.652896489058	  -3.193075323530
H 	   2.149642219779	  -3.486292572323	  -4.085630193770
O 	  -1.103674778373	  -6.110628132033	  -2.219661810424
S 	  -0.700071842614	  -6.555721435039	  -0.733638794601
O 	  -1.208924558312	  -7.891896714553	  -0.573266895147
O 	   0.661474447243	  -6.196102853635	  -0.421289341715
C 	  -1.783765606192	  -5.444281316845	   0.308251549623
F 	  -1.290375372995	  -4.221790534567	   0.344769070073
F 	  -3.008201466149	  -5.414932937502	  -0.181567138182
F 	  -1.810889579642	  -5.942204911165	   1.530343081573
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.4, θ = 130), G = -5220.599871565340
Pd	   0.442763234042	  -0.699576303310	  -2.584946234713
P 	  -0.629627395946	   1.367485265943	  -1.666701903357
Cl	  -1.567314499489	   1.917195826238	  -2.792725080059
Cl	  -1.480813985906	   0.934441101793	  -0.426530650890
Cl	   0.401431117423	   2.467788739035	  -1.247273455864
P 	   2.588123159772	  -0.969111575079	  -1.408937636651
Cl	   3.571385707274	   0.084578357619	  -2.019102241540
Cl	   3.177062455866	  -2.411305302311	  -1.538941062164
Cl	   2.307966265434	  -0.627496431310	   0.092416131602
C 	   0.327453576711	  -2.424205178837	  -3.605373806462
Cl	   0.502217809183	  -1.172772727763	  -5.279059823295
C 	  -1.055749880957	  -2.587540620493	  -3.292377037262
C 	  -1.517850326093	  -3.800617880662	  -2.784381770562
C 	  -0.644251309120	  -4.874987639528	  -2.704964296618
C 	   0.667819638188	  -4.789859992774	  -3.186309975721
C 	   1.148799506318	  -3.582567375820	  -3.658624204160
H 	  -1.767836631946	  -1.780339279994	  -3.485077580827
H 	  -2.562937823384	  -3.919826384428	  -2.491315012679
H 	   1.306667015855	  -5.675094461483	  -3.174507840611
H 	   2.165300511695	  -3.514533874467	  -4.049051082021
O 	  -1.134392348146	  -6.105666960275	  -2.220587331218
S 	  -0.747129573809	  -6.579876645526	  -0.739111714982
O 	  -1.269743964596	  -7.913640976949	  -0.605846498159
O 	   0.614993446827	  -6.237909096702	  -0.410260408985
C 	  -1.830173096557	  -5.475783211409	   0.310893329730
F 	  -1.326275088392	  -4.258580804943	   0.370013322536
F 	  -3.049889984644	  -5.427945374465	  -0.189124929949
F 	  -1.872404555705	  -5.992257758973	   1.524750417203
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.4, θ = 140), G = -5220.600496254064
Pd	   0.534986942055	  -0.792968574737	  -2.301611546291
P 	  -0.717657780849	   0.839394444300	  -0.874001476774
Cl	  -1.952229315423	   1.255937254139	  -1.740200268061
Cl	  -1.175823940994	   0.068820365768	   0.408038532300
Cl	   0.106013171501	   2.108647197871	  -0.474986210777
P 	   2.873775166410	  -0.253845557296	  -2.267224654526
Cl	   3.493622783669	  -0.453540385641	  -3.686096412461
Cl	   3.502352406242	  -1.222028541509	  -1.212994892427
Cl	   3.020347220833	   1.231958451944	  -1.800221903277
C 	   0.636098279848	  -2.459835826829	  -3.366764950829
Cl	   1.099467896959	  -1.574914222969	  -5.535759547968
C 	  -0.776910793881	  -2.548921011490	  -3.250050664848
C 	  -1.388270547451	  -3.754380763031	  -2.871444246790
C 	  -0.593063777719	  -4.863495719242	  -2.658039004717
C 	   0.796151773325	  -4.826435233138	  -2.849540546488
C 	   1.403912433263	  -3.640212752105	  -3.211416567487
H 	  -1.415285344132	  -1.713254548948	  -3.560502213576
H 	  -2.473405856995	  -3.830039657578	  -2.775441132598
H 	   1.386465143563	  -5.730207011254	  -2.688009812115
H 	   2.484344609128	  -3.619308898968	  -3.357852763574
O 	  -1.211154168924	  -6.079832496541	  -2.301077803220
S 	  -1.110739126075	  -6.615901378156	  -0.793467382117
O 	  -1.675239859870	  -7.938386286066	  -0.810110841324
O 	   0.171973556276	  -6.319506643934	  -0.204741096110
C 	  -2.346532951676	  -5.516701058795	   0.069972991340
F 	  -1.852667013041	  -4.302264964851	   0.217458118943
F 	  -3.466073746481	  -5.460104861815	  -0.624585187027
F 	  -2.588864179662	  -6.038677886039	   1.257613105150
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.4, θ = 150), G = -5220.597556039036
Pd	   0.578189821220	  -0.764059715952	  -2.285823647389
P 	  -0.701984692607	   0.952560046180	  -0.954831343384
Cl	  -1.715344054627	   1.559560923888	  -1.980813609260
Cl	  -1.455526546541	   0.196497905670	   0.188632291345
Cl	   0.191568090448	   2.087116671088	  -0.352019011452
P 	   2.936993203570	  -0.244019024525	  -2.290159177767
Cl	   3.529156920639	  -0.428498103689	  -3.722918589218
Cl	   3.590679283291	  -1.215118072430	  -1.254127597526
Cl	   3.085176157968	   1.239137241964	  -1.814526276797
C 	   0.632051582606	  -2.445872609083	  -3.332138240297
Cl	   1.028465702134	  -1.538571621938	  -5.479472009099
C 	  -0.777411818688	  -2.522387312187	  -3.170393263258
C 	  -1.389578274720	  -3.725711858450	  -2.785395083183
C 	  -0.600212489414	  -4.846326942483	  -2.615425912137
C 	   0.782831658552	  -4.819377060273	  -2.846567910157
C 	   1.392013332045	  -3.635224434292	  -3.211516663717
H 	  -1.416077494756	  -1.678539247109	  -3.457367227958
H 	  -2.472285138885	  -3.793298060360	  -2.659634529473
H 	   1.367623770074	  -5.732172427757	  -2.718639559959
H 	   2.466298948777	  -3.625241026919	  -3.393715697549
O 	  -1.217571757762	  -6.068197596561	  -2.279877592549
S 	  -1.091647641944	  -6.655274331390	  -0.793349560159
O 	  -1.564928167373	  -8.011583924432	  -0.864454607609
O 	   0.161858323143	  -6.293107349583	  -0.179537230261
C 	  -2.412271163304	  -5.677846522002	   0.086123871984
F 	  -2.011097812160	  -4.433439200474	   0.264209500856
F 	  -3.526725652710	  -5.687388357099	  -0.618455648670
F 	  -2.624651109084	  -6.243624556702	   1.259135946980
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.4, θ = 160), G = -5220.591321928596
Pd	   0.579279866117	  -0.770541474338	  -2.265785221379
P 	  -0.821077341187	   1.045040988542	  -1.148415742121
Cl	  -1.749573327911	   1.576140924530	  -2.290088132638
Cl	  -1.661730581731	   0.384474523586	  -0.006724186606
Cl	   0.039940864184	   2.219120807665	  -0.574029175140
P 	   2.958996975583	  -0.271238851529	  -2.163584981024
Cl	   3.410041611324	   0.243357399326	  -3.567655748884
Cl	   3.743453189327	  -1.552283743200	  -1.732985920967
Cl	   3.114310507745	   0.850072921402	  -1.083329819243
C 	   0.641455152648	  -2.479160931180	  -3.269249597417
Cl	   1.127919205318	  -1.523940472675	  -5.379441707214
C 	  -0.772378216593	  -2.538943695082	  -3.155315008117
C 	  -1.412249179803	  -3.733751788253	  -2.794916936577
C 	  -0.646391467282	  -4.870812359677	  -2.621219162157
C 	   0.739302210229	  -4.865344858508	  -2.829344074732
C 	   1.375691776427	  -3.683636217110	  -3.158283122789
H 	  -1.390347291370	  -1.682488212952	  -3.448977059728
H 	  -2.498247161325	  -3.785137181525	  -2.694071289471
H 	   1.306113060888	  -5.790521616039	  -2.713809078034
H 	   2.450589350805	  -3.695094967877	  -3.330213628589
O 	  -1.302954481916	  -6.079766920622	  -2.312480138401
S 	  -1.148537388889	  -6.737289411223	  -0.859315769756
O 	  -1.816928933654	  -8.008362474730	  -0.934588248812
O 	   0.189376614254	  -6.586581175124	  -0.342596800302
C 	  -2.232260373068	  -5.618770326584	   0.166464162798
F 	  -1.644803448053	  -4.450852504021	   0.341911089384
F 	  -3.394398378651	  -5.446403261109	  -0.432589791251
F 	  -2.418999833565	  -6.197291688557	   1.337576711570
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.4, θ = 170), G = -5220.584223217083
Pd	   0.611177991898	  -0.753284811585	  -2.265078141933
P 	  -0.861062293001	   1.154778334162	  -1.316714375561
Cl	  -1.563718813689	   1.770583703991	  -2.571569282042
Cl	  -1.910807858849	   0.550848633252	  -0.327052790247
Cl	  -0.009785886544	   2.251838708658	  -0.593865988903
P 	   3.036384086154	  -0.310659180394	  -2.097372981215
Cl	   3.435808899874	   0.557674583227	  -3.333784755220
Cl	   3.859562801956	  -1.637698892296	  -2.040679419056
Cl	   3.204334384434	   0.498763723295	  -0.769030550886
C 	   0.616882844626	  -2.482133713123	  -3.228673426671
Cl	   1.105646919488	  -1.436574076948	  -5.274155043844
C 	  -0.792986510434	  -2.536081729721	  -3.094618170644
C 	  -1.431830443634	  -3.730369256458	  -2.734677928082
C 	  -0.669811310734	  -4.875639560629	  -2.596805781668
C 	   0.708406530697	  -4.875623044719	  -2.842293769313
C 	   1.344584388936	  -3.691426841482	  -3.166245994107
H 	  -1.408574680700	  -1.669108817668	  -3.358889953822
H 	  -2.515390653700	  -3.777306765515	  -2.610413245712
H 	   1.270249724609	  -5.807774523040	  -2.766591858675
H 	   2.411026630481	  -3.708395600198	  -3.377488026735
O 	  -1.327698173959	  -6.085656806170	  -2.298741489050
S 	  -1.144654797612	  -6.778168631115	  -0.864559089787
O 	  -1.814076274796	  -8.047469594284	  -0.957982704864
O 	   0.202928446932	  -6.638295606930	  -0.371156211635
C 	  -2.210671329216	  -5.684167806836	   0.204774626115
F 	  -1.623531041722	  -4.517892567421	   0.390470001565
F 	  -3.384850154959	  -5.504932527637	  -0.367867828522
F 	  -2.371950446675	  -6.285833899312	   1.368005802856
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.4, θ = 180), G = -5220.575293763746
Pd	   0.671361367841	  -0.668070568011	  -2.340608529499
P 	  -0.889995404338	   1.392042572730	  -1.726272392483
Cl	  -1.706914571367	   1.741775350080	  -3.013665499738
Cl	  -1.840827603079	   1.024176755347	  -0.539838754774
Cl	   0.008568242542	   2.611161351623	  -1.327594078212
P 	   3.158506755199	  -0.597961803390	  -1.702480093291
Cl	   3.802427388032	   0.422937557030	  -2.698126351796
Cl	   3.889290079194	  -1.978294879271	  -1.759375526782
Cl	   3.186936825081	  -0.012267956836	  -0.251421781096
C 	   0.453171245335	  -2.406724050800	  -3.282245585401
Cl	   0.721392240229	  -1.184313086790	  -5.074861644126
C 	  -0.931276778986	  -2.513219555195	  -2.998540376998
C 	  -1.483768397657	  -3.733109571821	  -2.604759411943
C 	  -0.679447494071	  -4.860471664872	  -2.590675848277
C 	   0.658256006103	  -4.807725097912	  -2.991142493647
C 	   1.218889125114	  -3.592852424338	  -3.350916053292
H 	  -1.590509537329	  -1.657654810275	  -3.153817270748
H 	  -2.545717342309	  -3.817426444192	  -2.367745150815
H 	   1.245616242797	  -5.726434925323	  -3.026588774837
H 	   2.244770958446	  -3.559867438793	  -3.710921347888
O 	  -1.272909472661	  -6.101548617961	  -2.287375200218
S 	  -1.015285776473	  -6.806180829775	  -0.870467188646
O 	  -1.608208860809	  -8.112643498469	  -0.971262496678
O 	   0.332920643504	  -6.590233631047	  -0.408655318478
C 	  -2.121460902913	  -5.798770460332	   0.244217950093
F 	  -1.594819716429	  -4.608792017658	   0.454881384143
F 	  -3.313459800627	  -5.667035601706	  -0.304868757026
F 	  -2.231912480461	  -6.440501218937	   1.392068214804
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.4, θ = 190), G = -5220.566327998845
Pd	   0.920873152548	  -0.585545575358	  -2.287041132820
P 	  -0.923538499525	   1.379873134264	  -2.037745452814
Cl	  -1.612384809349	   1.671855501361	  -3.410752751990
Cl	  -1.976039358560	   1.145583116744	  -0.904572095575
Cl	   0.006053323853	   2.579240970477	  -1.647825747994
P 	   3.458708674337	  -0.725110268862	  -1.621451704126
Cl	   4.118552462510	   0.318631828906	  -2.583809140341
Cl	   4.188235731763	  -2.104702209245	  -1.703626621728
Cl	   3.490263015300	  -0.164443006867	  -0.159911639711
C 	   0.259489796231	  -2.246264657944	  -3.193464969702
Cl	   0.457172234252	  -1.057400916334	  -4.930978999752
C 	  -1.095236909701	  -2.440601319444	  -2.836128521956
C 	  -1.566714672611	  -3.699064558517	  -2.478387405737
C 	  -0.707740629006	  -4.788042981286	  -2.533476704547
C 	   0.612316443762	  -4.645588397381	  -2.951830027565
C 	   1.089771430625	  -3.386984363667	  -3.292604106525
H 	  -1.787259137553	  -1.603477242836	  -2.868327658171
H 	  -2.610061073059	  -3.842968813104	  -2.192729463755
H 	   1.251618103063	  -5.525529840567	  -3.034307183903
H 	   2.098996648431	  -3.280941314092	  -3.685610005543
O 	  -1.231419394354	  -6.069086187822	  -2.277064075684
S 	  -0.943819573952	  -6.817549707743	  -0.888972780579
O 	  -1.373011682095	  -8.176857908773	  -1.080270649010
O 	   0.349716374420	  -6.467794219901	  -0.358880450012
C 	  -2.206449649499	  -6.014709556395	   0.223138506866
F 	  -1.843519138394	  -4.777728294634	   0.500417568292
F 	  -3.386361454760	  -6.009584668742	  -0.366110452888
F 	  -2.272618428790	  -6.715215109117	   1.339265289606
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.4, θ = 200), G = -5220.553917748389
Pd	   0.979094464325	  -0.595001489598	  -2.256817313840
P 	  -0.991013815301	   1.442977326817	  -2.140787250232
Cl	  -1.613368874520	   1.682475095550	  -3.554928480665
Cl	  -2.090817990712	   1.253815048356	  -1.044901385925
Cl	  -0.070527208104	   2.651163109312	  -1.756174074141
P 	   3.573021592988	  -0.702637539333	  -1.572319685779
Cl	   4.214265138175	   0.346468819966	  -2.541484967534
Cl	   4.315125588251	  -2.075037056094	  -1.659742047046
Cl	   3.607321892818	  -0.138302798039	  -0.112378099897
C 	   0.267612817065	  -2.234770441097	  -3.173548296676
Cl	   0.434623336540	  -1.066154690866	  -4.878738076774
C 	  -1.072798030346	  -2.410611024947	  -2.752536647451
C 	  -1.554562488949	  -3.664372770890	  -2.393582469689
C 	  -0.724760020484	  -4.770725525573	  -2.505820498871
C 	   0.583448045632	  -4.645889857398	  -2.965339324248
C 	   1.074272090296	  -3.391946815019	  -3.303532111572
H 	  -1.746069021910	  -1.559154114122	  -2.739871510392
H 	  -2.587346145600	  -3.792633499960	  -2.066189085361
H 	   1.198505453768	  -5.537754313782	  -3.090613623972
H 	   2.068158981686	  -3.300308521864	  -3.736554760688
O 	  -1.274491786597	  -6.045953406083	  -2.276819289063
S 	  -0.972112348069	  -6.854932413534	  -0.926852632618
O 	  -1.402283901982	  -8.205270980582	  -1.172297346580
O 	   0.325819563706	  -6.525020870561	  -0.395345338133
C 	  -2.224804181737	  -6.104190722521	   0.230092178687
F 	  -1.870875650866	  -4.872338449200	   0.540742259277
F 	  -3.413466260059	  -6.093738181478	  -0.340944449405
F 	  -2.266378260111	  -6.840160484334	   1.324225950934
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.5, θ = 120), G = -5221.219029598093
Pd	   0.452378835437	  -0.670760216868	  -2.643384796251
P 	  -0.528202249671	   1.436879970906	  -1.803577887589
Cl	  -1.567202802358	   2.006551161181	  -2.914085829830
Cl	  -1.351478081235	   1.123219710291	  -0.439258380078
Cl	   0.572563261708	   2.589212286245	  -1.490937397160
P 	   2.416605721043	  -1.122636689368	  -1.251227564278
Cl	   3.585836563268	  -0.107772253421	  -1.742191999458
Cl	   2.975861451475	  -2.644004119636	  -1.321112445591
Cl	   2.050796567363	  -0.770425895905	   0.291377617752
C 	   0.234211131647	  -2.410166944917	  -3.674046794589
Cl	   0.385349878486	  -1.116703203136	  -5.224020542039
C 	  -1.128964502566	  -2.598367570500	  -3.307612520896
C 	  -1.541909749451	  -3.820257649999	  -2.780086277664
C 	  -0.641403587164	  -4.873642455039	  -2.727118079884
C 	   0.652932378206	  -4.758871488798	  -3.247142257067
C 	   1.086529177462	  -3.543410618585	  -3.742723514662
H 	  -1.859610975027	  -1.800257718469	  -3.459419522622
H 	  -2.570839920913	  -3.960447338724	  -2.442682724965
H 	   1.317463869680	  -5.624824128693	  -3.244869688016
H 	   2.092896861787	  -3.444138773005	  -4.152974612322
O 	  -1.085484194273	  -6.111179867992	  -2.220631146881
S 	  -0.649527269979	  -6.562729915889	  -0.744492201176
O 	  -1.132614588044	  -7.908519962315	  -0.588823902006
O 	   0.710125309805	  -6.180251620005	  -0.453572903616
C 	  -1.737820952026	  -5.477903123604	   0.319883506770
F 	  -1.274731542394	  -4.243410679876	   0.343490704135
F 	  -2.972470297473	  -5.480692794890	  -0.144164295681
F 	  -1.725697315027	  -5.974494665892	   1.542347077807
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.5, θ = 130), G = -5221.217533983458
Pd	   0.469440548464	  -0.667866853345	  -2.630180724050
P 	  -0.565652127108	   1.424396767440	  -1.799412347596
Cl	  -1.346847457335	   2.146301542219	  -3.026359130792
Cl	  -1.650357774773	   1.015962669897	  -0.661758347816
Cl	   0.479545011209	   2.488357468138	  -1.156909402705
P 	   2.534293639569	  -1.027005399054	  -1.350474591527
Cl	   3.609593690952	   0.059358127033	  -1.899770818261
Cl	   3.177082419532	  -2.511988933402	  -1.467343557792
Cl	   2.236559965107	  -0.703382650708	   0.212811357536
C 	   0.250387621535	  -2.417142757413	  -3.628543519103
Cl	   0.392390441775	  -1.129323709681	  -5.216413990783
C 	  -1.111787987202	  -2.591455427143	  -3.257231113498
C 	  -1.539873554934	  -3.812114398382	  -2.738032246390
C 	  -0.652319514474	  -4.876509838030	  -2.696105423367
C 	   0.643606438428	  -4.771839093872	  -3.213934731337
C 	   1.090620889504	  -3.557407612521	  -3.701958513939
H 	  -1.834968946729	  -1.785703623869	  -3.405574498613
H 	  -2.571216384910	  -3.943299634797	  -2.404704332137
H 	   1.296552390958	  -5.646579189254	  -3.220997755835
H 	   2.095340142782	  -3.469278951208	  -4.118017964349
O 	  -1.114990448966	  -6.115894525039	  -2.212025800639
S 	  -0.695802398611	  -6.600343536424	  -0.741480218115
O 	  -1.192107298710	  -7.944442125071	  -0.616538029266
O 	   0.664717416316	  -6.235516838803	  -0.432684164470
C 	  -1.784620202663	  -5.526055069284	   0.333299532029
F 	  -1.302484640659	  -4.300436079090	   0.394484176674
F 	  -3.011571959527	  -5.497461924047	  -0.149859769519
F 	  -1.799936939718	  -6.053334971236	   1.542657547351
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.5, θ = 140), G = -5221.216090113593
Pd	   0.516756851233	  -0.658064517252	  -2.593547403347
P 	  -0.607243514266	   1.419826130304	  -1.802359422045
Cl	  -1.585200262684	   1.941815837469	  -2.988850670062
Cl	  -1.515471284732	   1.038018271564	  -0.511313410461
Cl	   0.396198980899	   2.628451707866	  -1.390813405890
P 	   2.647179302396	  -0.945418035217	  -1.389864793741
Cl	   3.671748746588	   0.149181920711	  -2.014733217819
Cl	   3.318056513261	  -2.418681423844	  -1.495908719755
Cl	   2.410179869382	  -0.582204881679	   0.175127171270
C 	   0.294226527318	  -2.411976160041	  -3.572990162611
Cl	   0.443425471088	  -1.126850012488	  -5.187499971617
C 	  -1.070802411339	  -2.569116765367	  -3.208850759115
C 	  -1.523646937271	  -3.789566229048	  -2.709794803618
C 	  -0.654630893338	  -4.868932955874	  -2.677732775948
C 	   0.648148524437	  -4.776718324458	  -3.180190904587
C 	   1.118291580332	  -3.562568387010	  -3.648874658890
H 	  -1.782386336930	  -1.753408047597	  -3.357489579205
H 	  -2.561081041725	  -3.909509849769	  -2.391809862924
H 	   1.285877024803	  -5.662489863390	  -3.195829691788
H 	   2.124987250875	  -3.487395789815	  -4.062015440623
O 	  -1.147241393192	  -6.110476826650	  -2.230921030171
S 	  -0.763196092363	  -6.645114371744	  -0.768194911096
O 	  -1.276866062188	  -7.986399807759	  -0.695469586376
O 	   0.594617212561	  -6.305269680326	  -0.421832345742
C 	  -1.862117906857	  -5.592114136929	   0.316354770630
F 	  -1.376029128613	  -4.370319806199	   0.412128168649
F 	  -3.082295877008	  -5.547502115857	  -0.182715686924
F 	  -1.895891732749	  -6.147202446473	   1.512934726122
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.5, θ = 150), G = -5221.212597380977
Pd	   0.551060891135	  -0.657865145984	  -2.551044740369
P 	  -0.659227855903	   1.406174405956	  -1.791263076845
Cl	  -1.626949381665	   1.886859144929	  -3.003185252508
Cl	  -1.579043708465	   1.011773218183	  -0.512422899384
Cl	   0.302326758945	   2.646925967890	  -1.375041258425
P 	   2.765001322010	  -0.854992590201	  -1.462713751811
Cl	   3.707829173779	   0.263359480484	  -2.168830856641
Cl	   3.482125937612	  -2.305279804620	  -1.581341705922
Cl	   2.606672200616	  -0.465919949631	   0.105967616935
C 	   0.331441930290	  -2.416033178234	  -3.509554236213
Cl	   0.495382448353	  -1.129179203433	  -5.159038995423
C 	  -1.036647364044	  -2.557411400785	  -3.157449086464
C 	  -1.513960237674	  -3.777627778412	  -2.679866817088
C 	  -0.662194716760	  -4.870272317781	  -2.657634917297
C 	   0.647183169439	  -4.789742711725	  -3.143868106413
C 	   1.140120429270	  -3.575236778756	  -3.589829395880
H 	  -1.735683681888	  -1.730847307773	  -3.304955904545
H 	  -2.556442281109	  -3.887286313199	  -2.375066199298
H 	   1.270444679045	  -5.685441446655	  -3.168222390998
H 	   2.149957776793	  -3.511659316184	  -3.996092256563
O 	  -1.179945438821	  -6.111986215325	  -2.241886709234
S 	  -0.824727151315	  -6.684246380743	  -0.785850811190
O 	  -1.354534826397	  -8.020631653602	  -0.751784243234
O 	   0.531023274767	  -6.367440993618	  -0.411469706171
C 	  -1.928552120056	  -5.642376487250	   0.303454356822
F 	  -1.436679372777	  -4.424934095093	   0.421906060374
F 	  -3.143269476799	  -5.583758789561	  -0.207222035165
F 	  -1.977119398483	  -6.214928925756	   1.491248941286
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.5, θ = 160), G = -5221.208028644444
Pd	   0.558817139897	  -0.660017647146	  -2.439133791731
P 	  -0.761552678138	   1.364335632454	  -1.661710547108
Cl	  -1.717624946615	   1.827180715498	  -2.889443236071
Cl	  -1.689211937785	   0.941393323059	  -0.398069732955
Cl	   0.166608261924	   2.623553719080	  -1.225495309070
P 	   2.897969893618	  -0.723368174620	  -1.615723728843
Cl	   3.882364903440	  -0.230174175951	  -2.808416804477
Cl	   3.386896586271	  -2.166713213137	  -1.060015985575
Cl	   2.979481632076	   0.362140256008	  -0.409965714870
C 	   0.390658646830	  -2.404049660541	  -3.397815833060
Cl	   0.612769737176	  -1.114183052796	  -5.118604744764
C 	  -0.989891237725	  -2.536851744196	  -3.105948557388
C 	  -1.503096824584	  -3.764341442860	  -2.681001145202
C 	  -0.665687286160	  -4.866502621319	  -2.651307926774
C 	   0.666996692755	  -4.787607888155	  -3.069980436991
C 	   1.192411893262	  -3.566958184583	  -3.457764636694
H 	  -1.675604430525	  -1.702413815749	  -3.271370245071
H 	  -2.559752335681	  -3.870676773530	  -2.428694493990
H 	   1.281696164779	  -5.689032838246	  -3.085513979865
H 	   2.222108668686	  -3.503838941087	  -3.808294765435
O 	  -1.215981682140	  -6.112812252731	  -2.295975419377
S 	  -0.908743359574	  -6.751587050710	  -0.856785930973
O 	  -1.483401882909	  -8.069281376156	  -0.885152302393
O 	   0.448983417985	  -6.496615463505	  -0.445050119889
C 	  -1.997649113908	  -5.713077347117	   0.249470438133
F 	  -1.475880875485	  -4.512642059807	   0.407138796630
F 	  -3.204257014479	  -5.608709273121	  -0.272560141461
F 	  -2.073835053097	  -6.317155215927	   1.420127917607
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.5, θ = 170), G = -5221.201787699078
Pd	   0.634128620521	  -0.639028685909	  -2.408803450711
P 	  -0.799951634484	   1.411751238922	  -1.745175940480
Cl	  -1.692949288056	   1.849285226354	  -3.028191178025
Cl	  -1.783772602199	   1.037186609478	  -0.509275646452
Cl	   0.122578455160	   2.674856310350	  -1.306740938797
P 	   3.013594907949	  -0.705128196771	  -1.594379171576
Cl	   3.983531839783	  -0.274027684729	  -2.822671378628
Cl	   3.514732277701	  -2.114210162917	  -0.966088143351
Cl	   3.106770363595	   0.445714017433	  -0.451379560211
C 	   0.366726702880	  -2.384656273828	  -3.350667297615
Cl	   0.570824026171	  -1.089413843593	  -5.042844141690
C 	  -1.004004221734	  -2.522325018951	  -3.027258998879
C 	  -1.511277000836	  -3.757025238622	  -2.619123483442
C 	  -0.676739795654	  -4.861896606805	  -2.629613256896
C 	   0.649202592773	  -4.774145613658	  -3.063764175382
C 	   1.167671130235	  -3.545320441607	  -3.438043128056
H 	  -1.688579350378	  -1.682004677458	  -3.154705884074
H 	  -2.562940148738	  -3.867287736110	  -2.348772821356
H 	   1.261809630079	  -5.675752965532	  -3.109995158384
H 	   2.188002937217	  -3.475473520510	  -3.812084313762
O 	  -1.227697256542	  -6.116296584068	  -2.307481448253
S 	  -0.925765450203	  -6.798951064142	  -0.887514460299
O 	  -1.495614573290	  -8.117084791190	  -0.960515867322
O 	   0.428518744710	  -6.551431816973	  -0.461101644464
C 	  -2.025945619907	  -5.797864131947	   0.241055023611
F 	  -1.506642919118	  -4.603076448793	   0.441827474542
F 	  -3.226871831839	  -5.677611979398	  -0.290743283397
F 	  -2.113747555965	  -6.438786485965	   1.390993895710
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.5, θ = 180), G = -5221.195007546427
Pd	   0.854868390377	  -0.583023785950	  -2.378856613206
P 	  -0.857601647178	   1.429162523523	  -1.907990874292
Cl	  -1.677060667583	   1.827425233246	  -3.251105824705
Cl	  -1.898360781765	   1.134849095652	  -0.697553931198
Cl	   0.070819731231	   2.694609438230	  -1.485968428638
P 	   3.258060120810	  -0.727212008991	  -1.588918280542
Cl	   4.268194657251	  -0.647263546091	  -2.857155351600
Cl	   3.654202077074	  -1.983534564109	  -0.642151604035
Cl	   3.428120834087	   0.643710010610	  -0.732661467849
C 	   0.274520548201	  -2.288881723971	  -3.273787144254
Cl	   0.435011354153	  -0.997365607116	  -4.931785998355
C 	  -1.069114866708	  -2.455595714174	  -2.874929422344
C 	  -1.544432895670	  -3.708674918627	  -2.495016306548
C 	  -0.701570115229	  -4.805801822027	  -2.583416346714
C 	   0.605147212748	  -4.683573115900	  -3.053939095740
C 	   1.089217712878	  -3.433434964745	  -3.412044532095
H 	  -1.752793273656	  -1.608932889709	  -2.896301414112
H 	  -2.579235517053	  -3.838345067181	  -2.173663739142
H 	   1.228965919527	  -5.572787666220	  -3.155032697253
H 	   2.091081575265	  -3.336315540652	  -3.827296052505
O 	  -1.228530674570	  -6.079079458117	  -2.304016106738
S 	  -0.896288615960	  -6.825626083250	  -0.923282742655
O 	  -1.327410843075	  -8.186016657595	  -1.099616795702
O 	   0.412349951988	  -6.470138702343	  -0.436099153008
C 	  -2.128425048938	  -6.022665500519	   0.223323575363
F 	  -1.758519327868	  -4.784745369772	   0.487216791399
F 	  -3.324024485254	  -6.019669322750	  -0.332719577752
F 	  -2.161598345240	  -6.721078838410	   1.341710756600
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.5, θ = 190), G = -5221.184781389662
Pd	   0.971623403232	  -0.613212389996	  -2.408676204790
P 	  -0.885430806005	   1.379394550977	  -2.165824250030
Cl	  -1.666459572469	   1.656297908664	  -3.560875956217
Cl	  -1.950639463236	   1.221340355527	  -0.951400996928
Cl	   0.058355483184	   2.664222645148	  -1.848410392545
P 	   3.443366674291	  -0.715540313026	  -1.626789029686
Cl	   3.676251751294	   0.817202172589	  -1.138340890349
Cl	   4.466150016180	  -1.010485931844	  -2.851835689271
Cl	   3.762248001758	  -1.704627091896	  -0.380975104024
C 	   0.275937098566	  -2.310035125920	  -3.236820231152
Cl	   0.503081200335	  -1.116302427900	  -4.951209867503
C 	  -1.075594370431	  -2.477219773721	  -2.866811054021
C 	  -1.554268505147	  -3.721677226588	  -2.468210694927
C 	  -0.702534725064	  -4.816755060643	  -2.494726621365
C 	   0.616918519751	  -4.697429945937	  -2.922288221848
C 	   1.101232437566	  -3.453768523596	  -3.305892223828
H 	  -1.760055510466	  -1.634809753539	  -2.920325652368
H 	  -2.597456114275	  -3.849453980004	  -2.174883572625
H 	   1.249241677713	  -5.584262313308	  -2.980359576071
H 	   2.109819060117	  -3.364198689201	  -3.704789632596
O 	  -1.229985432458	  -6.085805262393	  -2.198112642328
S 	  -0.965200659267	  -6.781067350310	  -0.776184096049
O 	  -1.360443784408	  -8.154783488718	  -0.932016376671
O 	   0.305213106963	  -6.382618288070	  -0.225342311116
C 	  -2.277336296314	  -5.966105617425	   0.267831053335
F 	  -1.940309581593	  -4.717187040664	   0.522824082440
F 	  -3.435087506310	  -5.994422008301	  -0.362488348622
F 	  -2.373043123602	  -6.636696596792	   1.399876123508
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.6, θ = 120), G = -5221.674614523804
Pd	   0.511590726773	  -0.631767368479	  -2.701750849491
P 	  -0.438082342354	   1.504782490105	  -1.957323983978
Cl	  -1.233273789195	   2.284902240711	  -3.226556286810
Cl	  -1.589634141760	   1.200437065490	  -0.759879873018
Cl	   0.664810569382	   2.610426856705	  -1.314316381189
P 	   2.385808822958	  -1.141429058720	  -1.241346296196
Cl	   3.531168898258	   0.079597409781	  -1.467780080470
Cl	   3.175285360491	  -2.614462738217	  -1.475621188816
Cl	   1.917916934060	  -1.076761772841	   0.380121875519
C 	   0.164611783030	  -2.409362269408	  -3.680893716183
Cl	   0.282294182315	  -1.103990518840	  -5.205510559005
C 	  -1.174472159841	  -2.591480773675	  -3.251169345257
C 	  -1.567903887284	  -3.815743463123	  -2.715242591131
C 	  -0.666677306520	  -4.869569497833	  -2.701377836135
C 	   0.610304111607	  -4.750323877575	  -3.258893568106
C 	   1.021566639294	  -3.532683001108	  -3.771136550862
H 	  -1.904512373883	  -1.785322386216	  -3.352623516162
H 	  -2.582845099265	  -3.955608387840	  -2.338054383796
H 	   1.277952608861	  -5.613434026039	  -3.279021134408
H 	   2.012986666829	  -3.428042316585	  -4.214582568142
O 	  -1.097883130453	  -6.110781210962	  -2.197464859974
S 	  -0.619877284582	  -6.595717370285	  -0.743600227462
O 	  -1.072871240427	  -7.954444845025	  -0.616881428926
O 	   0.737570662459	  -6.191911290965	  -0.474193554305
C 	  -1.706678328887	  -5.563690872226	   0.371102767056
F 	  -1.314540260616	  -4.304660801091	   0.360333847884
F 	  -2.962358895999	  -5.642056231649	  -0.023427525747
F 	  -1.596664745348	  -6.046908550960	   1.594031437418
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.6, θ = 130), G = -5221.673254398742
Pd	   0.518290200111	  -0.630528248618	  -2.672124471669
P 	  -0.484960606013	   1.491954949148	  -1.937875339822
Cl	  -1.293399422757	   2.247052328641	  -3.213753859561
Cl	  -1.633690298204	   1.162859309671	  -0.744319627113
Cl	   0.588883989076	   2.625262599201	  -1.293992145686
P 	   2.482684630459	  -1.063630970144	  -1.293831864247
Cl	   3.618569224869	   0.118191576634	  -1.702648774341
Cl	   3.238719216973	  -2.563380540259	  -1.457431029735
Cl	   2.130687826391	  -0.850759875601	   0.344111132218
C 	   0.185496829676	  -2.411908222492	  -3.634535790739
Cl	   0.300035371890	  -1.105538376080	  -5.179784425435
C 	  -1.155308396779	  -2.592061207777	  -3.212008716922
C 	  -1.559079915358	  -3.820368003742	  -2.692266974069
C 	  -0.663725069536	  -4.878855589170	  -2.686449568253
C 	   0.618803886532	  -4.758320928178	  -3.230699866881
C 	   1.039426644892	  -3.536560969510	  -3.726124093370
H 	  -1.882889182821	  -1.783663122386	  -3.313367427567
H 	  -2.578343304568	  -3.960335740502	  -2.327246623850
H 	   1.281437677805	  -5.625129870624	  -3.257055555815
H 	   2.033129535237	  -3.432851415687	  -4.164364180551
O 	  -1.107326807677	  -6.126199808333	  -2.210195184691
S 	  -0.662363885561	  -6.631860630296	  -0.753049587267
O 	  -1.132520471620	  -7.986677155716	  -0.649704536484
O 	   0.694109148747	  -6.245743021578	  -0.454259207812
C 	  -1.761410868502	  -5.597370419170	   0.349004882873
F 	  -1.313417029256	  -4.358890126239	   0.409637560592
F 	  -2.996746636852	  -5.601354984639	  -0.112819611193
F 	  -1.739499307427	  -6.133338103232	   1.554096510000
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.6, θ = 140), G = -5221.671163310804
Pd	   0.565240038674	  -0.624847490105	  -2.634686564636
P 	  -0.558562194670	   1.455191230848	  -1.906428749386
Cl	  -1.604155647637	   2.003286601926	  -3.113785256762
Cl	  -1.502108790706	   1.114517599228	  -0.547757268550
Cl	   0.451738915030	   2.746347491333	  -1.501632808084
P 	   2.624523958380	  -0.964568233052	  -1.350800664640
Cl	   3.741629641855	   0.155294110230	  -1.944081590271
Cl	   3.351086319317	  -2.486058512779	  -1.418214218335
Cl	   2.383965745075	  -0.589952949006	   0.278360132622
C 	   0.246131684396	  -2.408272303118	  -3.572596599717
Cl	   0.383313106103	  -1.098345587312	  -5.152728317415
C 	  -1.103160907142	  -2.569568046589	  -3.174488092430
C 	  -1.540295908818	  -3.796961991684	  -2.679044925789
C 	  -0.665562414999	  -4.871993554836	  -2.673664401145
C 	   0.629881583183	  -4.766343702205	  -3.189006740709
C 	   1.082541725947	  -3.544643707833	  -3.658243620234
H 	  -1.817052671000	  -1.750498922342	  -3.285174693198
H 	  -2.569987342347	  -3.923484150418	  -2.339723501256
H 	   1.275973005831	  -5.645486752806	  -3.217052463407
H 	   2.084905531496	  -3.455305094423	  -4.078984609556
O 	  -1.146168338832	  -6.119366048546	  -2.235997962987
S 	  -0.746479039469	  -6.673821154585	  -0.783388303205
O 	  -1.247820217896	  -8.020225459354	  -0.729023541393
O 	   0.610633972839	  -6.325570185377	  -0.443907815197
C 	  -1.849034454993	  -5.645676339802	   0.321155018496
F 	  -1.374316302558	  -4.420364463227	   0.427159279383
F 	  -3.072431178811	  -5.608058793243	  -0.170096753374
F 	  -1.868836838353	  -6.215230157815	   1.510776653514
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.6, θ = 150), G = -5221.667844990623
Pd	   0.602060171954	  -0.616871229524	  -2.597584063009
P 	  -0.606651683449	   1.450823469155	  -1.905897852837
Cl	  -1.647695540521	   1.952851860416	  -3.136838011538
Cl	  -1.557692411105	   1.106723402759	  -0.553485214241
Cl	   0.365692567911	   2.773254011936	  -1.508652078060
P 	   2.738200746994	  -0.891575476084	  -1.402315915780
Cl	   3.809082450205	   0.204240555301	  -2.113996811103
Cl	   3.473833841716	  -2.409868466524	  -1.428473511464
Cl	   2.582930597051	  -0.427985184884	   0.214334248659
C 	   0.271773052315	  -2.403684632807	  -3.514884170712
Cl	   0.417777396978	  -1.094786302921	  -5.118119386923
C 	  -1.078988167969	  -2.555607881031	  -3.122793244482
C 	  -1.533358692291	  -3.784740465358	  -2.646964183610
C 	  -0.671717664985	  -4.869951745997	  -2.654773377928
C 	   0.628243373397	  -4.770425573216	  -3.158757248734
C 	   1.097200621154	  -3.546260390562	  -3.606982264715
H 	  -1.784646904611	  -1.729222179570	  -3.228631986416
H 	  -2.566570097175	  -3.904399510590	  -2.316128755927
H 	   1.263202443551	  -5.657088344964	  -3.198732308542
H 	   2.100612861926	  -3.463669781191	  -4.025909818157
O 	  -1.171805357057	  -6.119696252260	  -2.247633826912
S 	  -0.796090481461	  -6.711770192557	  -0.803379659865
O 	  -1.303456623706	  -8.056881269880	  -0.789754235172
O 	   0.556854652013	  -6.376992400437	  -0.435633006971
C 	  -1.911394518354	  -5.705949473810	   0.307729365643
F 	  -1.440242658086	  -4.481848028481	   0.439810525427
F 	  -3.129589382687	  -5.662475754739	  -0.195671134001
F 	  -1.941971613813	  -6.296149329055	   1.487059549702
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.6, θ = 160), G = -5221.663077458660
Pd	   0.663084025334	  -0.608614724008	  -2.553673006979
P 	  -0.649967135644	   1.466830476191	  -1.943797549821
Cl	  -1.614430885470	   1.947565102811	  -3.243472663818
Cl	  -1.674627149744	   1.148043777967	  -0.640072798857
Cl	   0.301607831730	   2.795195889648	  -1.516128786188
P 	   2.864090679057	  -0.829783458823	  -1.438724104009
Cl	   3.860640927534	   0.300275511512	  -2.202963114848
Cl	   3.650624974101	  -2.321409419091	  -1.498074971552
Cl	   2.769996672224	  -0.364091808204	   0.182054111174
C 	   0.277251571233	  -2.394775582284	  -3.450873559122
Cl	   0.413906489681	  -1.082331169597	  -5.060432986983
C 	  -1.068299270637	  -2.542520719269	  -3.045063959788
C 	  -1.531268683529	  -3.776562619842	  -2.591446300654
C 	  -0.680327195407	  -4.869568821895	  -2.629017405682
C 	   0.618073966920	  -4.770022746310	  -3.134611378088
C 	   1.093865949740	  -3.540487897934	  -3.563089852224
H 	  -1.765929958630	  -1.707506000029	  -3.126707985192
H 	  -2.563408415116	  -3.894191025287	  -2.256774118910
H 	   1.244170024315	  -5.661527944737	  -3.197435239955
H 	   2.092079775151	  -3.459763966312	  -3.993334846713
O 	  -1.191736037470	  -6.124581162224	  -2.255071564834
S 	  -0.835049741183	  -6.754879956439	  -0.822175391590
O 	  -1.337072692840	  -8.101686344223	  -0.852768606901
O 	   0.510434725604	  -6.424199876638	  -0.425503180145
C 	  -1.972208482567	  -5.783285604779	   0.296245113532
F 	  -1.510169736856	  -4.560151391574	   0.464283326060
F 	  -3.182619077036	  -5.734519446822	  -0.225067923691
F 	  -2.017120170584	  -6.401455638713	   1.460640368101
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.6, θ = 170), G = -5221.657070673269
Pd	   0.782726227102	  -0.574874925256	  -2.531942801914
P 	  -0.676614817332	   1.502734065083	  -2.041911364131
Cl	  -1.584148446449	   1.938904802577	  -3.396903288297
Cl	  -1.748542065177	   1.246644383608	  -0.762908583649
Cl	   0.271670133239	   2.840121147445	  -1.633808194522
P 	   3.035224315612	  -0.765983686516	  -1.490226242295
Cl	   3.943721728537	   0.441987450879	  -2.245317911609
Cl	   3.885761081729	  -2.214422699937	  -1.650437680061
Cl	   2.993808698446	  -0.371984033127	   0.151640246619
C 	   0.271507124310	  -2.360408725839	  -3.381851805464
Cl	   0.380459542900	  -1.067299148849	  -5.000675185895
C 	  -1.055504576204	  -2.501715998484	  -2.923655801362
C 	  -1.518906038900	  -3.739357516873	  -2.482086902121
C 	  -0.684196893789	  -4.842047614787	  -2.572878162283
C 	   0.601722302934	  -4.743369677894	  -3.106022109413
C 	   1.076386503293	  -3.509535230728	  -3.526061056542
H 	  -1.740264246186	  -1.653924248267	  -2.950847786538
H 	  -2.540940593365	  -3.851706450566	  -2.116452473463
H 	   1.215394230252	  -5.639917909351	  -3.207209297436
H 	   2.060837563068	  -3.430371586780	  -3.986457591290
O 	  -1.201208279128	  -6.103765977465	  -2.234399135994
S 	  -0.854773762699	  -6.784654247878	  -0.822212906861
O 	  -1.247581783432	  -8.162349723520	  -0.944084376838
O 	   0.441169365654	  -6.370909632920	  -0.347401779959
C 	  -2.115974647203	  -5.970408727766	   0.285274401854
F 	  -1.770361601320	  -4.719671314098	   0.519956400157
F 	  -3.303868930681	  -6.003122253275	  -0.285872872707
F 	  -2.151909155311	  -6.638597086311	   1.421695884341
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.6, θ = 180), G = -5221.649377387158
Pd	   0.931172382396	  -0.573936393734	  -2.505839965252
P 	  -0.776449599687	   1.449061254109	  -2.134773541744
Cl	  -1.671097485466	   1.813325231472	  -3.519002199991
Cl	  -1.850361863563	   1.268926584940	  -0.844792063982
Cl	   0.172473784449	   2.806279451410	  -1.797588363608
P 	   3.228441276721	  -0.725435603590	  -1.505810929379
Cl	   3.974869253228	   0.680005904690	  -2.074271078821
Cl	   4.215746153243	  -2.024660789189	  -1.935439762221
Cl	   3.222131144942	  -0.613166213275	   0.179110257793
C 	   0.260879921717	  -2.328413234075	  -3.307952216190
Cl	   0.417324572839	  -1.075384533665	  -4.952322390944
C 	  -1.067634384243	  -2.468809084002	  -2.858686798417
C 	  -1.543577038893	  -3.709169107126	  -2.442772557492
C 	  -0.715840282713	  -4.817838144142	  -2.539346666032
C 	   0.579266234160	  -4.718092503193	  -3.043592857047
C 	   1.064037475885	  -3.479421436093	  -3.441481355768
H 	  -1.740544427711	  -1.613458614135	  -2.867379649369
H 	  -2.569494607532	  -3.821603908707	  -2.088460584081
H 	   1.190360285567	  -5.615564867226	  -3.149804412250
H 	   2.051223463132	  -3.401672787946	  -3.895140106274
O 	  -1.253717654345	  -6.080280043436	  -2.239543409150
S 	  -0.916295358907	  -6.820737979691	  -0.855991453360
O 	  -1.338076413655	  -8.184422572377	  -1.027786649095
O 	   0.389707671584	  -6.452280979197	  -0.372033569413
C 	  -2.156417551830	  -6.021127388983	   0.284357249694
F 	  -1.792747182050	  -4.780635680652	   0.544964605316
F 	  -3.349786802306	  -6.025261541285	  -0.276087417506
F 	  -2.189999987065	  -6.716231587803	   1.404409506915
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.6, θ = 190), G = -5221.640437965078
Pd	   1.026194273232	  -0.615643973628	  -2.435029747774
P 	  -0.863639520272	   1.434564450395	  -2.264954462467
Cl	  -1.991307192661	   1.507285304565	  -3.518414368468
Cl	  -1.692308178829	   1.540181567255	  -0.797636067456
Cl	   0.093269320661	   2.822520262322	  -2.383893003847
P 	   3.384899779427	  -0.687584099573	  -1.487851791697
Cl	   3.727951523338	   0.942956304981	  -1.204491303316
Cl	   4.543322838402	  -1.238922174932	  -2.584674396306
Cl	   3.607733561837	  -1.496300060594	  -0.023626929923
C 	   0.291361343277	  -2.326712523916	  -3.244817638839
Cl	   0.502173907142	  -1.106117110770	  -4.906678410272
C 	  -1.043368661820	  -2.455580863971	  -2.810327265378
C 	  -1.541718293421	  -3.692503557255	  -2.411839844168
C 	  -0.728930549630	  -4.812297770525	  -2.504806725542
C 	   0.577356599579	  -4.724120569721	  -2.979948188378
C 	   1.084379334262	  -3.488192249901	  -3.359168268435
H 	  -1.703894021769	  -1.592639264145	  -2.817163241438
H 	  -2.573737941528	  -3.794454095628	  -2.072737147346
H 	   1.178715044255	  -5.628230129405	  -3.083141650359
H 	   2.079633606071	  -3.420456955051	  -3.795501130603
O 	  -1.293599382093	  -6.069661032240	  -2.233533097986
S 	  -0.991492639941	  -6.841869051747	  -0.859564640102
O 	  -1.438773604863	  -8.193126806342	  -1.062219592744
O 	   0.314526509523	  -6.509243674466	  -0.350690923111
C 	  -2.230141710441	  -6.037250611230	   0.277904610160
F 	  -1.852720038032	  -4.803663104445	   0.551913462457
F 	  -3.418937292128	  -6.021433500202	  -0.291754882946
F 	  -2.281355633673	  -6.741511276723	   1.391588268636
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.7, θ = 120), G = -5221.992273554651
Pd	   0.532255018434	  -0.601027749338	  -2.731239240844
P 	  -0.368746083691	   1.562567648411	  -2.064878968234
Cl	  -1.028615119880	   2.477105134428	  -3.415460736558
Cl	  -1.711577397304	   1.314801501196	  -0.954754257621
Cl	   0.726362328696	   2.667186161078	  -1.241926848815
P 	   2.338132368775	  -1.126944587071	  -1.228746967990
Cl	   3.612784879040	   0.056528296761	  -1.499876792685
Cl	   3.121407945295	  -2.697975548518	  -1.336112534965
Cl	   1.882952481465	  -0.936997065225	   0.460594294325
C 	   0.104197544338	  -2.410334065668	  -3.657658953321
Cl	   0.195172374613	  -1.076694071583	  -5.173937515186
C 	  -1.216235510077	  -2.598243411255	  -3.191838773799
C 	  -1.593234046230	  -3.833176750828	  -2.668639737413
C 	  -0.687530456924	  -4.883085422629	  -2.693343933702
C 	   0.579072657496	  -4.746902728814	  -3.267212387120
C 	   0.972308929976	  -3.517956733307	  -3.769432010839
H 	  -1.946320677918	  -1.787830642437	  -3.246917324553
H 	  -2.597544042412	  -3.982047866329	  -2.267638456365
H 	   1.254074614466	  -5.603276909364	  -3.308499534499
H 	   1.957633007356	  -3.397374874850	  -4.222217537243
O 	  -1.102935861411	  -6.133193270135	  -2.203140329869
S 	  -0.590611973519	  -6.646379852945	  -0.769307854248
O 	  -1.031395099404	  -8.010555341489	  -0.663583986133
O 	   0.768846833557	  -6.236719926673	  -0.521413210928
C 	  -1.665309965500	  -5.644360674667	   0.383528636189
F 	  -1.280444490629	  -4.383108510562	   0.390295984812
F 	  -2.925960105272	  -5.723079578580	   0.006006774409
F 	  -1.533147173448	  -6.150929726491	   1.594293825504
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.7, θ = 130), G = -5221.991098924882
Pd	   0.586180629918	  -0.593853737754	  -2.710510942642
P 	  -0.433505986692	   1.528534338925	  -2.042881853405
Cl	  -1.351653751106	   2.274440786738	  -3.345353985777
Cl	  -1.594104747221	   1.227061407593	  -0.754845261862
Cl	   0.632940256005	   2.789609704821	  -1.435629554388
P 	   2.475704966202	  -1.049826828086	  -1.279371752961
Cl	   3.723550787220	   0.122797780056	  -1.687801770852
Cl	   3.260063298916	  -2.622356130584	  -1.349927617508
Cl	   2.120407977036	  -0.768780305897	   0.421204016695
C 	   0.156673909562	  -2.406323740115	  -3.612196898879
Cl	   0.258308615930	  -1.074019602951	  -5.153237818649
C 	  -1.169184232659	  -2.578393505859	  -3.158545704783
C 	  -1.571846492739	  -3.812245263688	  -2.651705328407
C 	  -0.682708235394	  -4.875764907376	  -2.678626073262
C 	   0.593415045778	  -4.751982736450	  -3.233606360599
C 	   1.010830160690	  -3.523900089320	  -3.720132287178
H 	  -1.888731471932	  -1.759047356736	  -3.218193224328
H 	  -2.584092156135	  -3.949574289255	  -2.266981903042
H 	   1.254653846779	  -5.618955030827	  -3.277500079613
H 	   2.000718379499	  -3.415667402550	  -4.165715075215
O 	  -1.126834153746	  -6.127136284209	  -2.218780565698
S 	  -0.660248856015	  -6.672055288794	  -0.781076791278
O 	  -1.111250576146	  -8.035418047614	  -0.715961193467
O 	   0.693203669184	  -6.274396615979	  -0.485251628425
C 	  -1.765051367454	  -5.686620657517	   0.357878454648
F 	  -1.355362028493	  -4.435045026465	   0.422587060099
F 	  -3.009385274788	  -5.725816693486	  -0.076161541533
F 	  -1.697099232295	  -6.235271043513	   1.555267304648
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.7, θ = 140), G = -5221.988722118463
Pd	   0.624884327127	  -0.585698214839	  -2.663817182288
P 	  -0.499719105327	   1.508094724235	  -2.026068938685
Cl	  -1.619484382101	   2.049617092136	  -3.270538813540
Cl	  -1.478229369315	   1.253724194696	  -0.585756169196
Cl	   0.521701639059	   2.896169988749	  -1.671035785488
P 	   2.607997913100	  -0.960452613053	  -1.321125558085
Cl	   3.833098245824	   0.163844863081	  -1.899125340676
Cl	   3.374398229057	  -2.543321937411	  -1.319674616876
Cl	   2.369197948740	  -0.540674533916	   0.371291739012
C 	   0.202547512419	  -2.399376363117	  -3.547359027373
Cl	   0.317229978434	  -1.067796968192	  -5.111909971988
C 	  -1.128487824096	  -2.560959763280	  -3.108089521076
C 	  -1.553774155916	  -3.797090897612	  -2.624900465802
C 	  -0.679512391911	  -4.872123422666	  -2.661216236751
C 	   0.606130582863	  -4.755206956359	  -3.195106485647
C 	   1.045366923056	  -3.524485710471	  -3.656580870108
H 	  -1.839950980449	  -1.735114078491	  -3.170641979847
H 	  -2.573706439453	  -3.927527891013	  -2.259032753229
H 	   1.254722483578	  -5.631161511996	  -3.248159470251
H 	   2.039112960116	  -3.424210566258	  -4.094861358937
O 	  -1.151600947088	  -6.127630363120	  -2.243860984659
S 	  -0.731914384557	  -6.718763499079	  -0.810054215127
O 	  -1.206486905492	  -8.075568950198	  -0.794646045246
O 	   0.619564733492	  -6.351784183306	  -0.469258121892
C 	  -1.852054025571	  -5.744536827868	   0.324308736233
F 	  -1.404319434092	  -4.511774648544	   0.457609514852
F 	  -3.077226015154	  -5.723154728196	  -0.162844395459
F 	  -1.853894136444	  -6.343042800786	   1.499395940460
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.7, θ = 150), G = -5221.985059496487
Pd	   0.670565701227	  -0.577235558662	  -2.633769470515
P 	  -0.546313644394	   1.500561626932	  -2.033329996459
Cl	  -1.665866161321	   1.996103100633	  -3.296892766597
Cl	  -1.529813412614	   1.246799335182	  -0.596410027651
Cl	   0.439630829602	   2.918040172695	  -1.693732306849
P 	   2.728329732674	  -0.894911261208	  -1.362268723288
Cl	   3.895792397613	   0.236152059510	  -2.038154383097
Cl	   3.526696420835	  -2.461813863471	  -1.355512893048
Cl	   2.569213142602	  -0.425569350003	   0.326495445198
C 	   0.221698131322	  -2.392776747738	  -3.493804085005
Cl	   0.342065817455	  -1.061492077045	  -5.076086054977
C 	  -1.109583610239	  -2.547409986696	  -3.056363074924
C 	  -1.549233107268	  -3.785521382548	  -2.591546313232
C 	  -0.686158116114	  -4.868827467917	  -2.641763445893
C 	   0.602721902484	  -4.756368107479	  -3.167339254833
C 	   1.054899074089	  -3.522992321764	  -3.611080427729
H 	  -1.813247841809	  -1.714971269460	  -3.110063722745
H 	  -2.572096270500	  -3.911538126708	  -2.232515456286
H 	   1.241719423978	  -5.638462482581	  -3.232583832626
H 	   2.048619828318	  -3.427929693584	  -4.049928738079
O 	  -1.175071311231	  -6.126482752250	  -2.252280921514
S 	  -0.778663711275	  -6.751500029309	  -0.826259134523
O 	  -1.252626303175	  -8.108380017652	  -0.850790895583
O 	   0.566466595388	  -6.391649355033	  -0.454860732790
C 	  -1.917984412429	  -5.804750937360	   0.311276919061
F 	  -1.480013674663	  -4.571335428543	   0.469234860907
F 	  -3.137620608344	  -5.783631483333	  -0.189264406484
F 	  -1.928533832315	  -6.422113161495	   1.476535461885
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.7, θ = 160), G = -5221.980778507677
Pd	   0.748866271118	  -0.554711579021	  -2.603211372994
P 	  -0.572556606876	   1.520080152559	  -2.073841725138
Cl	  -1.692977977602	   1.945215373366	  -3.361809586192
Cl	  -1.552089429996	   1.325777059086	  -0.625180354315
Cl	   0.401080554455	   2.960725374652	  -1.801714024997
P 	   2.876433973590	  -0.823129791024	  -1.422163250046
Cl	   3.979316556913	   0.321452521929	  -2.179091737990
Cl	   3.707966503677	  -2.372588764498	  -1.432893564860
Cl	   2.797412537319	  -0.324401094541	   0.263800829218
C 	   0.233625178749	  -2.369991182234	  -3.427650537867
Cl	   0.330569921047	  -1.043184995168	  -5.025212357902
C 	  -1.086428399799	  -2.518330472462	  -2.959695873570
C 	  -1.531501467696	  -3.759728482447	  -2.509087586482
C 	  -0.682783174548	  -4.851678669733	  -2.599609687337
C 	   0.598320202428	  -4.741562892756	  -3.142227037355
C 	   1.055023248925	  -3.504416402557	  -3.572715295715
H 	  -1.779922048386	  -1.676664952597	  -2.979829125842
H 	  -2.548383872292	  -3.881668846213	  -2.132336159073
H 	   1.224836816656	  -5.629744947755	  -3.238246126087
H 	   2.038981348485	  -3.412407459596	  -4.032793688868
O 	  -1.178310351546	  -6.115188247837	  -2.241089950158
S 	  -0.803656547421	  -6.773622287574	  -0.824135451861
O 	  -1.182419355157	  -8.156893819892	  -0.922654133897
O 	   0.494439184249	  -6.338317549119	  -0.375424760068
C 	  -2.059316289654	  -5.956777156297	   0.288532729753
F 	  -1.721914394629	  -4.700180966713	   0.503353453224
F 	  -3.252836637644	  -6.006803167252	  -0.269097869862
F 	  -2.076182764462	  -6.611263321169	   1.432965868612
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.7, θ = 170), G = -5221.974504546746
Pd	   0.890401781245	  -0.554070493646	  -2.587524682400
P 	  -0.666741995062	   1.470456367356	  -2.143250108597
Cl	  -1.781870300119	   1.817414758854	  -3.458642043255
Cl	  -1.644851221836	   1.334987990677	  -0.687215871782
Cl	   0.284462432793	   2.937638072227	  -1.938574707620
P 	   3.059361957173	  -0.762966509867	  -1.457387081577
Cl	   3.988483397106	   0.610388471460	  -2.049692196537
Cl	   4.068503786013	  -2.174993501293	  -1.741473329867
Cl	   2.997767680859	  -0.549729450910	   0.288291508695
C 	   0.248809313966	  -2.351807887865	  -3.357134557898
Cl	   0.383535437597	  -1.057014796689	  -4.985272539251
C 	  -1.070505716553	  -2.483954605794	  -2.887278326970
C 	  -1.538374555195	  -3.723521376251	  -2.457583377963
C 	  -0.709824882579	  -4.830293944593	  -2.563956559751
C 	   0.576633874880	  -4.733166742944	  -3.091987338095
C 	   1.054263208986	  -3.496253849448	  -3.503677696220
H 	  -1.743759731504	  -1.627359442734	  -2.886715946309
H 	  -2.557504988856	  -3.834272123807	  -2.083675057002
H 	   1.188166147194	  -5.630130367387	  -3.200855922365
H 	   2.038084129100	  -3.416141239581	  -3.965243855054
O 	  -1.235943477015	  -6.090572206838	  -2.241155847662
S 	  -0.874884444474	  -6.808136585580	  -0.849906840981
O 	  -1.276132616786	  -8.180189261272	  -1.000526730663
O 	   0.429101177291	  -6.411003482603	  -0.383656953593
C 	  -2.119309700297	  -6.011344935520	   0.288357815444
F 	  -1.769557460893	  -4.763395717078	   0.532032285763
F 	  -3.315208074363	  -6.036914246580	  -0.265574632038
F 	  -2.137512178776	  -6.693659459175	   1.416222215871
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.7, θ = 180), G = -5221.966939199349
Pd	   0.992265509945	  -0.587788297396	  -2.543037122513
P 	  -0.765131600081	   1.434864032958	  -2.219740119328
Cl	  -1.826539056723	   1.728401491611	  -3.591145344633
Cl	  -1.787989382943	   1.378902510314	  -0.789602857561
Cl	   0.190368926507	   2.904491646499	  -2.052727301134
P 	   3.228424400071	  -0.718148116312	  -1.494476904729
Cl	   3.839353120271	   0.930978270510	  -1.585476291091
Cl	   4.439369942536	  -1.700479745055	  -2.308280878861
Cl	   3.303232377396	  -1.142391746368	   0.210986761313
C 	   0.267433835725	  -2.348254609953	  -3.296840565419
Cl	   0.457629565478	  -1.082974850500	  -4.949117086626
C 	  -1.058420922399	  -2.469383057851	  -2.843481795542
C 	  -1.547384666144	  -3.705152048677	  -2.427971575604
C 	  -0.732293289994	  -4.822591878616	  -2.527788071528
C 	   0.564117926455	  -4.737057878262	  -3.030302488506
C 	   1.062055396791	  -3.502770824245	  -3.427501834420
H 	  -1.720748811333	  -1.606254341233	  -2.843575881531
H 	  -2.572955451413	  -3.806181440888	  -2.069552567802
H 	   1.166151796222	  -5.640451928512	  -3.136966475691
H 	   2.051348114100	  -3.434735062485	  -3.878054255207
O 	  -1.284604165810	  -6.077423460141	  -2.228410242548
S 	  -0.945450434666	  -6.830332367062	  -0.850727380561
O 	  -1.380615455137	  -8.188665023809	  -1.028918375423
O 	   0.366832352105	  -6.475453326130	  -0.374161580341
C 	  -2.172217491641	  -6.024418415712	   0.299607166124
F 	  -1.798577151415	  -4.786012020189	   0.556316804514
F 	  -3.369472454060	  -6.021570084543	  -0.251764674172
F 	  -2.200589949940	  -6.719153994848	   1.419652561161
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.7, θ = 190), G = -5221.958649093203
Pd	   1.182761524075	  -0.696180124928	  -2.459418109894
P 	  -0.915673893267	   1.517453762062	  -2.351569712453
Cl	  -2.461036332893	   1.386705640002	  -3.182621359336
Cl	  -1.285138061008	   2.076566231983	  -0.723806091471
Cl	  -0.073003739048	   2.856431071520	  -3.123508624499
P 	   3.367500485482	  -0.675558694133	  -1.329803538276
Cl	   3.786423405745	   1.022956138822	  -1.128594610854
Cl	   4.667903754370	  -1.353138565786	  -2.301431262033
Cl	   3.513975479016	  -1.387486994544	   0.271525471650
C 	   0.324799300131	  -2.369338221315	  -3.265901198752
Cl	   0.514346417611	  -1.054794506477	  -4.837302167700
C 	  -0.981177538118	  -2.448198004335	  -2.748407503297
C 	  -1.505538327730	  -3.676004144460	  -2.355042891534
C 	  -0.746673211887	  -4.823334477611	  -2.531347667963
C 	   0.532368429525	  -4.775119047295	  -3.081627233373
C 	   1.067152073104	  -3.550388940774	  -3.460264694508
H 	  -1.598645609093	  -1.555679115398	  -2.682472290439
H 	  -2.517675913935	  -3.745223757098	  -1.953651485289
H 	   1.089939422609	  -5.698967389742	  -3.242270794071
H 	   2.041162909938	  -3.506763023828	  -3.946686107363
O 	  -1.342489674840	  -6.064105161728	  -2.259689108894
S 	  -1.007023691895	  -6.875377156485	  -0.914080539902
O 	  -1.458001413034	  -8.221027958092	  -1.142258018014
O 	   0.310490964123	  -6.552213815361	  -0.429796106632
C 	  -2.223953492827	  -6.101505876010	   0.267792086107
F 	  -1.842122325328	  -4.874019624667	   0.562958251730
F 	  -3.423015329699	  -6.073734133123	  -0.278453324632
F 	  -2.252062631307	  -6.831960678181	   1.364670253994
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.8, θ = 120), G = -5222.198420292111
Pd	   0.582475842465	  -0.560114480378	  -2.764955421924
P 	  -0.318256306227	   1.608561676499	  -2.167856846684
Cl	  -1.141825303028	   2.492903550569	  -3.550566436329
Cl	  -1.639102646360	   1.413056054850	  -0.906718513100
Cl	   0.810435502009	   2.864693215090	  -1.446123725929
P 	   2.335525134587	  -1.076668087647	  -1.232067572273
Cl	   3.741880416414	   0.064338324250	  -1.540542691155
Cl	   3.109757352484	  -2.741007220079	  -1.207096422485
Cl	   1.897152154293	  -0.762388294014	   0.523712243613
C 	   0.087453849035	  -2.403114658888	  -3.611193848513
Cl	   0.161053275027	  -1.056170168771	  -5.156971503223
C 	  -1.219654073441	  -2.583036814072	  -3.120761892216
C 	  -1.598745094931	  -3.825391592006	  -2.615988046940
C 	  -0.701263530885	  -4.880960846634	  -2.676391587572
C 	   0.561139767304	  -4.740840643825	  -3.255878709759
C 	   0.955120987674	  -3.503897324770	  -3.740884274361
H 	  -1.941364069559	  -1.763536397046	  -3.140131575684
H 	  -2.597876350817	  -3.974100425004	  -2.202728156041
H 	   1.232134336088	  -5.598932911706	  -3.318393131260
H 	   1.936296463762	  -3.379230739649	  -4.201160989739
O 	  -1.122505812033	  -6.138500922163	  -2.216662415082
S 	  -0.597910702539	  -6.705436425668	  -0.806408602097
O 	  -1.019093552092	  -8.078823367213	  -0.758495530496
O 	   0.755449134976	  -6.284706963049	  -0.545536186082
C 	  -1.687515643404	  -5.767257160502	   0.383969199690
F 	  -1.321313886313	  -4.501419471744	   0.436949418406
F 	  -2.946117625899	  -5.850769093798	   0.001634363083
F 	  -1.547736638690	  -6.317255379511	   1.574190476504
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.8, θ = 130), G = -5222.196785096239
Pd	   0.626112346505	  -0.536967717201	  -2.745575767611
P 	  -0.323855895338	   1.636431986721	  -2.203659282838
Cl	  -1.153811252603	   2.462227262357	  -3.618304306427
Cl	  -1.650463860312	   1.452002594914	  -0.946929695432
Cl	   0.774652458364	   2.934969773319	  -1.511101947338
P 	   2.459425669389	  -1.003041189880	  -1.286844162006
Cl	   3.807890335817	   0.180503360351	  -1.681828656356
Cl	   3.288845549719	  -2.640733568066	  -1.289459231819
Cl	   2.104890738319	  -0.680194416710	   0.486203641384
C 	   0.101666374326	  -2.386778666474	  -3.560411494261
Cl	   0.156782876057	  -1.051332369760	  -5.123185822963
C 	  -1.198469894668	  -2.555912524394	  -3.049755361968
C 	  -1.585944262318	  -3.798495407637	  -2.551199425257
C 	  -0.703066891939	  -4.864023890509	  -2.636742685434
C 	   0.556238547922	  -4.731073157339	  -3.224245850903
C 	   0.958250937571	  -3.494134221312	  -3.703131446198
H 	  -1.912555215106	  -1.729720597428	  -3.054994215590
H 	  -2.581876659316	  -3.941191696186	  -2.128170549761
H 	   1.215319169520	  -5.596944641650	  -3.304883259730
H 	   1.934016991711	  -3.376942728991	  -4.176393880983
O 	  -1.138706830395	  -6.126087996007	  -2.205783083713
S 	  -0.630244213665	  -6.734521684823	  -0.807114720920
O 	  -0.981892542675	  -8.128121417417	  -0.835472901372
O 	   0.690000854831	  -6.258367896837	  -0.481287881981
C 	  -1.808557723891	  -5.910304052203	   0.380614997927
F 	  -1.524644178207	  -4.625773833236	   0.479546256692
F 	  -3.048219961995	  -6.059386701420	  -0.040885569114
F 	  -1.666190487710	  -6.486091169063	   1.557937926311
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.8, θ = 140), G = -5222.194403740792
Pd	   0.686807221027	  -0.563401586465	  -2.704927328977
P 	  -0.453173405574	   1.532033559440	  -2.121685953631
Cl	  -1.623214539926	   2.106228173163	  -3.415176386416
Cl	  -1.505378655472	   1.300225235773	  -0.634495299638
Cl	   0.555614954788	   3.017625476013	  -1.737169292300
P 	   2.614493712783	  -0.948068349669	  -1.330789841074
Cl	   3.874848733858	   0.299597230491	  -1.810588411966
Cl	   3.519420895094	  -2.544275607087	  -1.388691630811
Cl	   2.360519554403	  -0.638046429085	   0.461690432702
C 	   0.179056579401	  -2.401052577743	  -3.515525114984
Cl	   0.283624468639	  -1.040790171223	  -5.100682104669
C 	  -1.140210967901	  -2.554447637798	  -3.054636124670
C 	  -1.566556718047	  -3.795130576693	  -2.584752362986
C 	  -0.697917463438	  -4.873926585259	  -2.648389909264
C 	   0.581750602159	  -4.756080407347	  -3.192952275493
C 	   1.020108787800	  -3.519866229199	  -3.645163498716
H 	  -1.842393756232	  -1.718977302216	  -3.080064429166
H 	  -2.580892990132	  -3.924297298860	  -2.203568362385
H 	   1.227136464081	  -5.633041386783	  -3.263275691438
H 	   2.010055320050	  -3.416472644339	  -4.090939140556
O 	  -1.170195062026	  -6.130700791157	  -2.241150800605
S 	  -0.735471104273	  -6.747101204516	  -0.820846177111
O 	  -1.190332580078	  -8.110433419476	  -0.833653265212
O 	   0.611391469314	  -6.365723062012	  -0.478744937384
C 	  -1.867225530201	  -5.813190412486	   0.334891431870
F 	  -1.445450769149	  -4.572235180396	   0.477760934392
F 	  -3.096136966865	  -5.813641857696	  -0.142099595209
F 	  -1.844685274206	  -6.424815524273	   1.502566758032
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.8, θ = 150), G = -5222.190940123150
Pd	   0.730339967171	  -0.549587827222	  -2.680313079253
P 	  -0.494193038014	   1.527170302949	  -2.124742430968
Cl	  -1.653295591063	   2.075849372411	  -3.438857024005
Cl	  -1.559024493419	   1.302592435526	  -0.645570399172
Cl	   0.497464627041	   3.026184160529	  -1.747097328674
P 	   2.736027878272	  -0.881137261886	  -1.385503094228
Cl	   3.959600901985	   0.345546453086	  -1.997026580537
Cl	   3.643887144467	  -2.476296585613	  -1.416290172088
Cl	   2.581737513014	  -0.477337086578	   0.399605511222
C 	   0.194833349573	  -2.389458678838	  -3.463325529866
Cl	   0.289885257495	  -1.038834783172	  -5.067565002561
C 	  -1.120979611876	  -2.539714097929	  -2.993693340562
C 	  -1.554279289394	  -3.782823675896	  -2.536136432461
C 	  -0.694109051538	  -4.866775771318	  -2.619843459543
C 	   0.584890550489	  -4.750011565156	  -3.165159724829
C 	   1.029374680668	  -3.511164876148	  -3.604911267314
H 	  -1.818658436488	  -1.700842101745	  -3.008627088891
H 	  -2.568453408411	  -3.911357320788	  -2.154032711658
H 	   1.221859419878	  -5.631545869889	  -3.252369972855
H 	   2.014239646981	  -3.410771066699	  -4.061716426289
O 	  -1.174999726983	  -6.128242383346	  -2.240172967580
S 	  -0.766666479574	  -6.769274031918	  -0.823056200586
O 	  -1.179699174795	  -8.144604017053	  -0.884467291030
O 	   0.556008159941	  -6.356380976388	  -0.428627652402
C 	  -1.964793744257	  -5.899695486639	   0.314809023461
F 	  -1.579385012579	  -4.653345354445	   0.506849428392
F 	  -3.173662102909	  -5.915357291211	  -0.210586090606
F 	  -1.972356955813	  -6.542791181486	   1.465368927231
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.8, θ = 160), G = -5222.186687924735
Pd	   0.843550045356	  -0.542022986144	  -2.661083489296
P 	  -0.566382715593	   1.486048221008	  -2.156612803600
Cl	  -1.809213165323	   1.892393632281	  -3.445492778265
Cl	  -1.538358523380	   1.344669832838	  -0.605109183232
Cl	   0.386227518952	   3.043196359384	  -1.951941305377
P 	   2.913341693199	  -0.807504903428	  -1.437012148451
Cl	   3.993743659840	   0.573970621478	  -1.984975835014
Cl	   3.960350224043	  -2.300755265763	  -1.646564115415
Cl	   2.806066936744	  -0.573829879792	   0.381491832800
C 	   0.227189892200	  -2.371912750405	  -3.395519559101
Cl	   0.352488695230	  -1.038346283768	  -5.032114010167
C 	  -1.089173498408	  -2.503748233584	  -2.925959383952
C 	  -1.546361288376	  -3.744246886558	  -2.485624866399
C 	  -0.707259295089	  -4.843677515305	  -2.583997744920
C 	   0.575988334934	  -4.742341161204	  -3.119659752872
C 	   1.043232063742	  -3.505031086667	  -3.542730697089
H 	  -1.768962937897	  -1.651348191606	  -2.928977378224
H 	  -2.563323768403	  -3.859279004618	  -2.107411856020
H 	   1.195840935079	  -5.634527207232	  -3.220308498790
H 	   2.027539199142	  -3.418496495664	  -4.002499070225
O 	  -1.216597635367	  -6.102817015971	  -2.236584141973
S 	  -0.832897321413	  -6.792403896380	  -0.835485813229
O 	  -1.218188104259	  -8.171395299663	  -0.959519006502
O 	   0.470553807074	  -6.370123701747	  -0.390454303858
C 	  -2.077700129053	  -5.990116214744	   0.299334122717
F 	  -1.738881126067	  -4.734947504225	   0.520513626214
F 	  -3.276607511816	  -6.036543908770	  -0.246173899003
F 	  -2.080613005205	  -6.654869840643	   1.437413681576
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.8, θ = 170), G = -5222.180196430378
Pd	   0.936717509079	  -0.554125757569	  -2.617369225734
P 	  -0.664261988184	   1.443437857912	  -2.178697278366
Cl	  -1.889600122461	   1.795112660689	  -3.499836323993
Cl	  -1.645811651551	   1.381596903886	  -0.628131091268
Cl	   0.293996993881	   3.004835570468	  -2.039554597316
P 	   3.065035399707	  -0.756153644145	  -1.465599370524
Cl	   4.044266548703	   0.697710339440	  -2.017041292283
Cl	   4.176301506418	  -2.183956261846	  -1.775655754548
Cl	   3.033943800268	  -0.582115180550	   0.362424265099
C 	   0.241400306460	  -2.357521650417	  -3.333308340747
Cl	   0.403797437465	  -1.039192639154	  -4.984191808791
C 	  -1.077119270079	  -2.482475222368	  -2.869455707465
C 	  -1.550902616836	  -3.723974713957	  -2.451716512301
C 	  -0.724622903972	  -4.832342902250	  -2.562322905305
C 	   0.564533400908	  -4.736486210607	  -3.081812514709
C 	   1.047604557845	  -3.497168135907	  -3.482981877775
H 	  -1.745085929822	  -1.622208014181	  -2.858338953930
H 	  -2.571005791018	  -3.834128357507	  -2.080584531526
H 	   1.174645784395	  -5.633952855371	  -3.193304329481
H 	   2.034277815575	  -3.415916084938	  -3.937870512301
O 	  -1.255563620375	  -6.090848801798	  -2.246861069675
S 	  -0.889748447953	  -6.823552584181	  -0.863247090635
O 	  -1.297415231751	  -8.192099835427	  -1.025104543415
O 	   0.418449009718	  -6.434996374373	  -0.402041521491
C 	  -2.125505749185	  -6.029620396613	   0.286542089132
F 	  -1.770976528178	  -4.783220405439	   0.531423204973
F 	  -3.324555571364	  -6.050780683193	  -0.260082078811
F 	  -2.137201667787	  -6.715863187493	   1.411661295569
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.8, θ = 180), G = -5222.173017618974
Pd	   1.022605563477	  -0.590090676272	  -2.548255293323
P 	  -0.751101670492	   1.431716999936	  -2.237908422475
Cl	  -2.105517803509	   1.577584402493	  -3.468537791574
Cl	  -1.568615895105	   1.620010603988	  -0.604291609804
Cl	   0.200031590935	   2.991092616461	  -2.437206539539
P 	   3.208003481408	  -0.707787444954	  -1.451591043934
Cl	   3.940405531087	   0.963619614702	  -1.668893260636
Cl	   4.480421046836	  -1.833711107650	  -2.146898986849
Cl	   3.279555705352	  -0.980465231216	   0.362760858932
C 	   0.267807463861	  -2.355386934517	  -3.278760202654
Cl	   0.479961865488	  -1.053849124338	  -4.926247660350
C 	  -1.055747867734	  -2.467876348268	  -2.824746654327
C 	  -1.551752415158	  -3.706005853776	  -2.424125881241
C 	  -0.742779256267	  -4.826542037108	  -2.539222747542
C 	   0.553585625309	  -4.743824161990	  -3.041506803248
C 	   1.058543467670	  -3.507445962338	  -3.424909684280
H 	  -1.711693937645	  -1.599922105849	  -2.811696903558
H 	  -2.576945211116	  -3.805285161445	  -2.064319903458
H 	   1.150307769103	  -5.649212752769	  -3.159722117848
H 	   2.047786686932	  -3.438852434527	  -3.875309012202
O 	  -1.301455672129	  -6.079924766637	  -2.252278637061
S 	  -0.956527016471	  -6.854763368713	  -0.886712958091
O 	  -1.392210367899	  -8.209942837526	  -1.084235271114
O 	   0.357637381727	  -6.505626572458	  -0.411443837557
C 	  -2.179799952634	  -6.063721883790	   0.277525953434
F 	  -1.809451906860	  -4.825263210212	   0.539344451618
F 	  -3.380104650946	  -6.062539049097	  -0.266499300957
F 	  -2.197356575326	  -6.765991778998	   1.392630881973
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.9, θ = 120), G = -5222.317076555759
Pd	   0.636782995476	  -0.537143050448	  -2.794879215825
P 	  -0.259384267771	   1.653092909954	  -2.294952567700
Cl	  -1.151234130055	   2.520012100424	  -3.755919901777
Cl	  -1.644027264336	   1.513674907661	  -0.973591707407
Cl	   0.856873301142	   3.050152506375	  -1.599143248580
P 	   2.318865228919	  -1.065046560049	  -1.220494987919
Cl	   3.740628055399	   0.217175211981	  -1.358821773052
Cl	   3.263573540426	  -2.734258243416	  -1.266074928947
Cl	   1.809691653435	  -0.918366447776	   0.623965602962
C 	   0.061259548956	  -2.399858347651	  -3.560557418676
Cl	   0.128070547460	  -1.030495590608	  -5.138710275812
C 	  -1.234455758702	  -2.567189344024	  -3.048353983022
C 	  -1.619845883207	  -3.815075120742	  -2.562015065257
C 	  -0.734964497884	  -4.878914585578	  -2.658304177039
C 	   0.522119467079	  -4.741229981147	  -3.247518271578
C 	   0.921658443608	  -3.497958065284	  -3.715384279192
H 	  -1.943407841407	  -1.736646326574	  -3.031123422079
H 	  -2.612690031095	  -3.961357605449	  -2.133227692221
H 	   1.184293959080	  -5.603841415659	  -3.334463442871
H 	   1.898300136746	  -3.373123027018	  -4.184706536927
O 	  -1.168313018929	  -6.138659312813	  -2.222003666122
S 	  -0.612900410113	  -6.763753089875	  -0.847399883865
O 	  -1.063981232054	  -8.127989862909	  -0.831731775276
O 	   0.757223305150	  -6.380740310576	  -0.619276820716
C 	  -1.644380033981	  -5.839116377966	   0.403653474265
F 	  -1.252511614677	  -4.581819723596	   0.474190385974
F 	  -2.915494563531	  -5.890120554443	   0.059776711243
F 	  -1.476156655634	  -6.421411259261	   1.574010490232
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.9, θ = 130), G = -5222.315500410533
Pd	   0.675534084805	  -0.512962303478	  -2.779157387145
P 	  -0.281214685846	   1.666395089276	  -2.293913893866
Cl	  -1.206942247316	   2.491477489888	  -3.757973133277
Cl	  -1.650302364541	   1.507821472911	  -0.958634874175
Cl	   0.804041417466	   3.099892752422	  -1.623574559931
P 	   2.474388851113	  -0.982696623913	  -1.307498645615
Cl	   3.892945302599	   0.261625178913	  -1.659821702027
Cl	   3.390203527309	  -2.668465728126	  -1.305964269518
Cl	   2.127583642676	  -0.689630593736	   0.557131958101
C 	   0.083014785869	  -2.381993874082	  -3.512047916946
Cl	   0.123611853467	  -1.026807228732	  -5.109865875073
C 	  -1.205720143357	  -2.544583075449	  -2.981560722181
C 	  -1.594436292482	  -3.793793710898	  -2.500214360943
C 	  -0.718551985294	  -4.862490487537	  -2.617157790338
C 	   0.534785477388	  -4.726944057388	  -3.214391255691
C 	   0.936485676775	  -3.483465386158	  -3.679715664700
H 	  -1.911663742253	  -1.712006072740	  -2.955041031330
H 	  -2.585051770331	  -3.937930513735	  -2.065481438309
H 	   1.188654306005	  -5.594259600092	  -3.317265438902
H 	   1.905700283550	  -3.363130409746	  -4.165126085239
O 	  -1.155696476971	  -6.128320089257	  -2.205140939213
S 	  -0.634927837227	  -6.768539826124	  -0.823331234904
O 	  -0.961528299452	  -8.166360545386	  -0.891553649470
O 	   0.676181657447	  -6.276234472215	  -0.485914027638
C 	  -1.829725565129	  -5.995779680066	   0.381763087118
F 	  -1.572303822983	  -4.707495040216	   0.503445588307
F 	  -3.065632142559	  -6.163162129604	  -0.042653845209
F 	  -1.673840510832	  -6.590167101620	   1.547600730435
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.9, θ = 140), G = -5222.313043645744
Pd	   0.723461348493	  -0.535393308915	  -2.745515400215
P 	  -0.403437994848	   1.563597926711	  -2.192431905685
Cl	  -1.649206825597	   2.182831932694	  -3.513737036796
Cl	  -1.501350203115	   1.375125934642	  -0.629961905440
Cl	   0.627252149902	   3.135785463322	  -1.808151432088
P 	   2.631189648096	  -0.906638868052	  -1.374720757539
Cl	   3.988653792704	   0.346473043958	  -1.895853007100
Cl	   3.578786021735	  -2.574668637536	  -1.356775309314
Cl	   2.418336435298	  -0.520933480712	   0.493198180138
C 	   0.156980542861	  -2.396377573591	  -3.474423405358
Cl	   0.232562358967	  -1.025742120263	  -5.095884856210
C 	  -1.149186371656	  -2.548486215576	  -2.987873430412
C 	  -1.567699532321	  -3.795752700866	  -2.527283111060
C 	  -0.699274807207	  -4.872655647399	  -2.622074539712
C 	   0.573368942416	  -4.746969872564	  -3.179057713679
C 	   1.003227805321	  -3.504515730413	  -3.624425092289
H 	  -1.849338424801	  -1.711009419520	  -2.985480015638
H 	  -2.575473320875	  -3.931599090112	  -2.131241049620
H 	   1.218464829348	  -5.622158011309	  -3.269568342660
H 	   1.984851964611	  -3.393779005017	  -4.086026905540
O 	  -1.163730543700	  -6.136109519015	  -2.234522331524
S 	  -0.726546152519	  -6.774771237725	  -0.823326195932
O 	  -1.111123700837	  -8.157960352226	  -0.886961430888
O 	   0.591011764228	  -6.334354539309	  -0.442143332258
C 	  -1.932971757411	  -5.933419562723	   0.326986709957
F 	  -1.569867552719	  -4.680146666020	   0.518080474302
F 	  -3.144989136788	  -5.971138843822	  -0.189326756852
F 	  -1.918358299689	  -6.579240465512	   1.475441521744
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.9, θ = 150), G = -5222.309691009091
Pd	   0.782292536963	  -0.537284971634	  -2.719970067956
P 	  -0.478256133867	   1.519739162450	  -2.176103221029
Cl	  -1.739311244912	   2.092144825392	  -3.503919947396
Cl	  -1.566413598660	   1.321884691990	  -0.608125164751
Cl	   0.513920791037	   3.121643539777	  -1.812803828909
P 	   2.744381386409	  -0.864862225344	  -1.403171832835
Cl	   4.063744613543	   0.375738770769	  -2.039712952884
Cl	   3.707177620485	  -2.523612715391	  -1.361583536864
Cl	   2.615238735885	  -0.395969474869	   0.453337840489
C 	   0.179787479183	  -2.391245515046	  -3.430434286982
Cl	   0.284781963898	  -1.014422692343	  -5.067836817979
C 	  -1.132821851006	  -2.535922379924	  -2.961288891674
C 	  -1.569178361128	  -3.783514561563	  -2.518894819745
C 	  -0.710331471606	  -4.868118984241	  -2.614934255830
C 	   0.569411597376	  -4.749171786967	  -3.155396264697
C 	   1.016436918930	  -3.505306913619	  -3.581876297563
H 	  -1.824701027986	  -1.692418002751	  -2.957914178995
H 	  -2.582803544683	  -3.914146443623	  -2.136229472918
H 	   1.205482614757	  -5.630362928400	  -3.250693276951
H 	   2.002559114965	  -3.400181386480	  -4.034562548694
O 	  -1.192974603434	  -6.130311570451	  -2.246658327630
S 	  -0.774243736324	  -6.793079782569	  -0.840856334562
O 	  -1.181367067617	  -8.168663487113	  -0.923399640570
O 	   0.548383491678	  -6.379178382845	  -0.447936235741
C 	  -1.971891340552	  -5.944540866228	   0.313182077024
F 	  -1.591023984662	  -4.698378418168	   0.515792425909
F 	  -3.182578539521	  -5.960354370724	  -0.207206555843
F 	  -1.970109379272	  -6.600109696941	   1.456138037930
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.9, θ = 160), G = -5222.305485327260
Pd	   0.902002031745	  -0.545707798117	  -2.703455027554
P 	  -0.586007089042	   1.427714761585	  -2.175103929696
Cl	  -1.949108857099	   1.854618945830	  -3.455908950436
Cl	  -1.555383580508	   1.318037322491	  -0.522961352755
Cl	   0.364236389419	   3.086817572305	  -2.006908536953
P 	   2.941923766204	  -0.799817070968	  -1.469027018791
Cl	   4.071159469948	   0.661472289319	  -1.993297930262
Cl	   4.093269891716	  -2.318263695658	  -1.690599138736
Cl	   2.868267468572	  -0.589639335101	   0.437075265982
C 	   0.226074738154	  -2.377332963292	  -3.371507898889
Cl	   0.396979114319	  -1.020459923949	  -5.047629044963
C 	  -1.093708385328	  -2.498809487100	  -2.920347603216
C 	  -1.560365641645	  -3.740211690352	  -2.492481404299
C 	  -0.721878024367	  -4.841549740273	  -2.583462782263
C 	   0.568345415944	  -4.743515464838	  -3.099989487097
C 	   1.044613976658	  -3.504862688193	  -3.512714309647
H 	  -1.765389151891	  -1.640307379411	  -2.919218107791
H 	  -2.581158237187	  -3.853973415629	  -2.124504877229
H 	   1.188054382590	  -5.636358013133	  -3.194119390319
H 	   2.036161280456	  -3.417899582912	  -3.956153529753
O 	  -1.237720898354	  -6.097491364281	  -2.240594791461
S 	  -0.854631335195	  -6.797198061792	  -0.842532204294
O 	  -1.246749248497	  -8.173179919787	  -0.974233027960
O 	   0.451583924940	  -6.382583760994	  -0.398803580209
C 	  -2.094412847709	  -5.991695376433	   0.295485143001
F 	  -1.749614227009	  -4.737829946718	   0.514845025400
F 	  -3.294082759827	  -6.033603800710	  -0.248046753951
F 	  -2.096868587094	  -6.656376978750	   1.433136866374
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.9, θ = 170), G = -5222.299321432950
Pd	   0.998313786617	  -0.580784738414	  -2.638899602451
P 	  -0.688935246969	   1.391261595139	  -2.185498263733
Cl	  -2.215675110915	   1.589790746848	  -3.330071652145
Cl	  -1.429563246356	   1.560994813018	  -0.423535267287
Cl	   0.231903071451	   3.059261032410	  -2.418708645113
P 	   3.089133724902	  -0.758963931408	  -1.469289988972
Cl	   3.989614281810	   0.913038637255	  -1.751817208263
Cl	   4.408411721982	  -2.035204567128	  -2.027132936687
Cl	   3.109944484020	  -0.914106526686	   0.443158619915
C 	   0.256409982087	  -2.375506752637	  -3.320073333044
Cl	   0.484766277855	  -1.032832017536	  -4.992196244100
C 	  -1.073338145833	  -2.490502685106	  -2.895951090739
C 	  -1.560665320258	  -3.730225731107	  -2.488568820902
C 	  -0.731814646426	  -4.839771789302	  -2.569439998850
C 	   0.570741258241	  -4.749317484189	  -3.053595223610
C 	   1.066782005094	  -3.511562036497	  -3.446663171312
H 	  -1.738291274198	  -1.628321698752	  -2.903840253510
H 	  -2.590680480881	  -3.837392201595	  -2.145073195767
H 	   1.183319553891	  -5.647367308536	  -3.143318731709
H 	   2.066417282002	  -3.432642384045	  -3.872429372066
O 	  -1.271247853251	  -6.093107279079	  -2.254167152577
S 	  -0.924818449705	  -6.820456350375	  -0.861027957308
O 	  -1.345477227489	  -8.185255081362	  -1.018362276350
O 	   0.383597264530	  -6.441754866566	  -0.392592497577
C 	  -2.161912186609	  -6.003478871799	   0.271480970180
F 	  -1.795888896904	  -4.758786855116	   0.507882611141
F 	  -3.356140574561	  -6.017206089099	  -0.285286839049
F 	  -2.189313054237	  -6.679806145210	   1.401959144223
28
TS_CCl-PdL2 (VL_PR3, r0 = 1.9, θ = 180), G = -5222.291710767089
Pd	   1.057114519892	  -0.613356776931	  -2.566299643990
P 	  -0.757332021144	   1.409657064824	  -2.249270670654
Cl	  -2.252342281719	   1.539432663680	  -3.444427796935
Cl	  -1.533055181746	   1.726156422692	  -0.522842342747
Cl	   0.196111002659	   3.041916238437	  -2.583254315818
P 	   3.213693727407	  -0.695203493867	  -1.464405131094
Cl	   3.920338630622	   1.089639634671	  -1.504821581768
Cl	   4.616742654078	  -1.704819808958	  -2.296683344945
Cl	   3.373031538015	  -1.157052086781	   0.390969719330
C 	   0.276970959446	  -2.379019657517	  -3.264438566683
Cl	   0.519306102087	  -1.047645338996	  -4.926011531508
C 	  -1.050287208204	  -2.479861934483	  -2.826750556198
C 	  -1.556082390366	  -3.716672368217	  -2.433822107297
C 	  -0.749365715169	  -4.839901732352	  -2.540380934723
C 	   0.552769492789	  -4.763600403266	  -3.027873782382
C 	   1.067596814569	  -3.528595883594	  -3.404979115060
H 	  -1.701253639476	  -1.608228426268	  -2.818548621288
H 	  -2.585444045100	  -3.812001925656	  -2.085159409314
H 	   1.147544618771	  -5.671141264051	  -3.138304718147
H 	   2.063852806196	  -3.461818348553	  -3.839872855378
O 	  -1.314351534079	  -6.089193337399	  -2.254503431097
S 	  -0.980196173749	  -6.862298540111	  -0.883624038508
O 	  -1.421183902050	  -8.215560043212	  -1.080386163699
O 	   0.333180345737	  -6.516772582323	  -0.403824773736
C 	  -2.206041902935	  -6.059896237107	   0.270483801697
F 	  -1.830331983585	  -4.822045985276	   0.527645168500
F 	  -3.403087759913	  -6.055414085909	  -0.280122134742
F 	  -2.232304493131	  -6.756708330360	   1.388450500521
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.0, θ = 120), G = -5222.370147202439
Pd	   0.670448177784	  -0.505591801720	  -2.865680297476
P 	  -0.190578096576	   1.689473799209	  -2.383232479395
Cl	  -1.131860104668	   2.643471243464	  -3.875512710257
Cl	  -1.648003815177	   1.552899318502	  -1.011629626796
Cl	   0.942323474488	   3.161398796760	  -1.626240675037
P 	   2.342191558284	  -1.006626771508	  -1.301834656966
Cl	   3.840353793304	   0.320351698029	  -1.443679784750
Cl	   3.356632666316	  -2.736954508574	  -1.299106508783
Cl	   1.849429231955	  -0.835975762576	   0.635223520371
C 	   0.041404345932	  -2.393791883674	  -3.529246792936
Cl	   0.071724311485	  -1.019230949099	  -5.160197972610
C 	  -1.235604868065	  -2.552234258639	  -2.977769554847
C 	  -1.609950842987	  -3.802646112763	  -2.487678229577
C 	  -0.729770131505	  -4.867348559181	  -2.615554681695
C 	   0.513023054265	  -4.728841016932	  -3.232276745603
C 	   0.901296738515	  -3.484063907188	  -3.707925556468
H 	  -1.939768701179	  -1.718865006940	  -2.931762635527
H 	  -2.590972757798	  -3.949090472388	  -2.032778397824
H 	   1.171274192327	  -5.592054159018	  -3.340399689094
H 	   1.864777344516	  -3.357750224321	  -4.202920757304
O 	  -1.151666513115	  -6.131072402500	  -2.187002861476
S 	  -0.584803200956	  -6.772223499626	  -0.821765587861
O 	  -0.901943595915	  -8.172116115584	  -0.886056987403
O 	   0.731360880159	  -6.269400676963	  -0.521987731691
C 	  -1.753412992979	  -6.010326199404	   0.415312913269
F 	  -1.505450969525	  -4.719268967525	   0.526263978244
F 	  -2.998336547720	  -6.191587137866	   0.025349043042
F 	  -1.558523651275	  -6.600541028872	   1.577033088823
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.0, θ = 130), G = -5222.368600889183
Pd	   0.723595186624	  -0.520062602540	  -2.840755771720
P 	  -0.291642156992	   1.623301597991	  -2.318405231574
Cl	  -1.176886683451	   2.617190566533	  -3.818822352271
Cl	  -1.835139400956	   1.309411895244	  -1.076081471342
Cl	   0.682460778737	   3.105634794593	  -1.381581419278
P 	   2.518109200870	  -0.962452485265	  -1.385979214822
Cl	   3.991867760252	   0.355887603013	  -1.726712287050
Cl	   3.532107505652	  -2.692937415561	  -1.381437769956
Cl	   2.198994327420	  -0.683736577321	   0.574861587623
C 	   0.087967215935	  -2.398256167603	  -3.494821773429
Cl	   0.142173082309	  -1.011864399274	  -5.141119584736
C 	  -1.199546635172	  -2.542867768698	  -2.965816498247
C 	  -1.598929351910	  -3.790356464717	  -2.488828893077
C 	  -0.730088713697	  -4.865127683255	  -2.607336210952
C 	   0.523539197575	  -4.740259993315	  -3.204377856204
C 	   0.935657417143	  -3.497980813833	  -3.668336338222
H 	  -1.894867509080	  -1.702249743024	  -2.930232650008
H 	  -2.589936746702	  -3.927230541814	  -2.052903652195
H 	   1.170176771025	  -5.612694320361	  -3.308608598933
H 	   1.905057236571	  -3.383290373878	  -4.154238897878
O 	  -1.174524090115	  -6.124678703331	  -2.190053258959
S 	  -0.651933774027	  -6.765505182309	  -0.807073056670
O 	  -0.984972298879	  -8.161585063807	  -0.873181810992
O 	   0.662049711324	  -6.276814284563	  -0.476181677307
C 	  -1.840854886105	  -5.983615267185	   0.398398564532
F 	  -1.577733244293	  -4.695876873460	   0.512819856089
F 	  -3.078178558483	  -6.148449191616	  -0.022032549435
F 	  -1.682928361820	  -6.573541107304	   1.565780439524
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.0, θ = 140), G = -5222.366084048431
Pd	   0.744530691741	  -0.523615478702	  -2.793620078980
P 	  -0.354147337859	   1.599375133771	  -2.284520299038
Cl	  -1.258264560026	   2.562296628415	  -3.793792956627
Cl	  -1.885734357391	   1.278439366329	  -1.029526430595
Cl	   0.607202770868	   3.105127856289	  -1.372072999471
P 	   2.633238161767	  -0.897029519731	  -1.429657178258
Cl	   4.060698625198	   0.414401376277	  -1.947617684570
Cl	   3.664660360806	  -2.617043423816	  -1.407723617186
Cl	   2.453398546766	  -0.513171089097	   0.531187799168
C 	   0.114369048834	  -2.399314694467	  -3.443519310111
Cl	   0.179221178718	  -1.008707799281	  -5.100061296882
C 	  -1.179983401704	  -2.542783305216	  -2.931860113910
C 	  -1.593614375308	  -3.792991132298	  -2.474589482621
C 	  -0.730575740970	  -4.871919893770	  -2.596146907164
C 	   0.532053672894	  -4.747333098685	  -3.173729818679
C 	   0.958042277865	  -3.501771510184	  -3.617049542984
H 	  -1.872888367088	  -1.700436119055	  -2.899791470444
H 	  -2.591864497865	  -3.929343055884	  -2.055319739936
H 	   1.172867510642	  -5.623387990491	  -3.283020297383
H 	   1.932552602660	  -3.388729763929	  -4.092656697089
O 	  -1.191700037908	  -6.134530619213	  -2.207490112692
S 	  -0.708872177263	  -6.797822665411	  -0.820827837099
O 	  -1.063634221068	  -8.187214845164	  -0.909095924094
O 	   0.605824611600	  -6.334465582879	  -0.458236166748
C 	  -1.909089593817	  -6.008814016708	   0.369369375641
F 	  -1.618522826049	  -4.730122551800	   0.513691605915
F 	  -3.138997272793	  -6.136175836458	  -0.084643369403
F 	  -1.795178313344	  -6.622922935737	   1.529262173535
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.0, θ = 150), G = -5222.362949132382
Pd	   0.896658121191	  -0.562232695550	  -2.774969282836
P 	  -0.560674224217	   1.375734833943	  -2.174934671797
Cl	  -2.041315793625	   1.863264060793	  -3.436859211756
Cl	  -1.545706669097	   1.192879052644	  -0.437354873169
Cl	   0.362486219803	   3.141152032489	  -1.938844205083
P 	   2.818988381523	  -0.865343373068	  -1.440645835115
Cl	   4.086799799405	   0.617608880749	  -1.909171718372
Cl	   4.017404358778	  -2.467966728736	  -1.575759472202
Cl	   2.681471398106	  -0.635885897589	   0.547574161165
C 	   0.211345238254	  -2.403597269506	  -3.406170338961
Cl	   0.417137078973	  -1.002702960931	  -5.099394124302
C 	  -1.115521872161	  -2.519150049356	  -2.983807463829
C 	  -1.584023381314	  -3.761184258888	  -2.559951672419
C 	  -0.736343088443	  -4.858351725099	  -2.625358815848
C 	   0.561313787210	  -4.760392725375	  -3.122155594345
C 	   1.039895045237	  -3.521383188272	  -3.533768825905
H 	  -1.786478907333	  -1.659409000224	  -2.991424526556
H 	  -2.609930675899	  -3.877907953619	  -2.207011296337
H 	   1.189048440495	  -5.649454576332	  -3.194961202159
H 	   2.042111903990	  -3.429421621709	  -3.951916255511
O 	  -1.249724237371	  -6.107707340522	  -2.260516200897
S 	  -0.847862330023	  -6.786462460381	  -0.855285993948
O 	  -1.339325413363	  -8.134449572089	  -0.923396993889
O 	   0.504761260976	  -6.452114917600	  -0.488766077707
C 	  -1.968596606946	  -5.853981360238	   0.311930511621
F 	  -1.514897229982	  -4.627948540629	   0.483293170874
F 	  -3.190799317176	  -5.812449440853	  -0.178437734027
F 	  -1.972628307084	  -6.491147770941	   1.465006165655
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.0, θ = 160), G = -5222.358646169694
Pd	   0.958736715340	  -0.555151027056	  -2.759101081391
P 	  -0.620840738445	   1.333917517749	  -2.143935880148
Cl	  -2.089022095405	   1.818183940852	  -3.421592761066
Cl	  -1.604218377028	   1.221328707086	  -0.399545047499
Cl	   0.336738294883	   3.087778274060	  -1.963334225215
P 	   2.995480159020	  -0.792168632590	  -1.541796321892
Cl	   4.137244149647	   0.785485706850	  -2.025591514154
Cl	   4.275847619437	  -2.308145446570	  -1.833258953428
Cl	   2.981705320466	  -0.652739998545	   0.459436243194
C 	   0.225324316067	  -2.384680689178	  -3.356106525177
Cl	   0.445760470715	  -1.007387022391	  -5.075027412894
C 	  -1.104685268587	  -2.507164396038	  -2.945504278208
C 	  -1.573483823139	  -3.750620479290	  -2.526787871096
C 	  -0.721890633947	  -4.845260026151	  -2.582534803811
C 	   0.580908321805	  -4.741543050223	  -3.062219590728
C 	   1.058172519503	  -3.500885510713	  -3.471692112307
H 	  -1.780447871495	  -1.652574281689	  -2.963546316181
H 	  -2.603736587317	  -3.870954209271	  -2.188392305541
H 	   1.211729373693	  -5.628808187839	  -3.130739635465
H 	   2.060932658251	  -3.408497724761	  -3.887442002519
O 	  -1.233960087556	  -6.099940818746	  -2.235638949518
S 	  -0.875716477706	  -6.778632775311	  -0.818631207831
O 	  -1.255659991309	  -8.158544726929	  -0.941014560660
O 	   0.417929842130	  -6.347764409058	  -0.354001664907
C 	  -2.145179438005	  -5.964410137186	   0.279906373153
F 	  -1.811098144894	  -4.706206926977	   0.490182396116
F 	  -3.331430314215	  -6.020241317023	  -0.290608628642
F 	  -2.169546932004	  -6.614378919925	   1.425460260032
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.0, θ = 170), G = -5222.353361995925
Pd	   1.023928244230	  -0.584733830170	  -2.658356541433
P 	  -0.697046108807	   1.361609334019	  -2.190820001423
Cl	  -2.292005862245	   1.607152519130	  -3.381561321161
Cl	  -1.494716826125	   1.584784437271	  -0.363895928849
Cl	   0.252222189330	   3.113105477214	  -2.428595114721
P 	   3.098799230104	  -0.755582427288	  -1.491273421822
Cl	   4.069268825094	   0.974001596498	  -1.798597699029
Cl	   4.495659471131	  -2.083934750575	  -2.044947707785
Cl	   3.175496822204	  -0.882282590249	   0.509326901258
C 	   0.251747476957	  -2.383978846670	  -3.297665547364
Cl	   0.502010057577	  -1.009990630645	  -4.986722962278
C 	  -1.080207040719	  -2.495652789629	  -2.887686770558
C 	  -1.570593660734	  -3.737750983335	  -2.491570246511
C 	  -0.739414258090	  -4.846214432739	  -2.569387618179
C 	   0.567026642928	  -4.754138382266	  -3.041316446099
C 	   1.066308386586	  -3.513845791992	  -3.424844769527
H 	  -1.744436304288	  -1.633225603697	  -2.896053434445
H 	  -2.603444906412	  -3.846947311684	  -2.157517295326
H 	   1.181093498007	  -5.651223522900	  -3.129303331671
H 	   2.069942827659	  -3.431905615453	  -3.840089824879
O 	  -1.279868041182	  -6.098978773267	  -2.260009458989
S 	  -0.937508222889	  -6.831601992233	  -0.866954899781
O 	  -1.359976099384	  -8.194845979969	  -1.030063991246
O 	   0.370573407397	  -6.455270424136	  -0.395983118197
C 	  -2.176119796496	  -6.013586981656	   0.263456078287
F 	  -1.809160603407	  -4.768872115707	   0.498500513450
F 	  -3.369195305308	  -6.027234630128	  -0.295243300018
F 	  -2.204791063200	  -6.688861524702	   1.394118880609
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.1, θ = 120), G = -5222.374846194159
Pd	   0.699377935843	  -0.507046280415	  -2.895023390377
P 	  -0.208975186474	   1.668689588924	  -2.397994360304
Cl	  -1.252835366232	   2.677773296462	  -3.910370357122
Cl	  -1.713493966537	   1.482341120945	  -0.949501219616
Cl	   0.898652919305	   3.248241693209	  -1.576935984996
P 	   2.361379308837	  -0.984910080047	  -1.336462801416
Cl	   4.014440052403	   0.275936961954	  -1.611365023614
Cl	   3.327568323854	  -2.839518974915	  -1.184461735394
Cl	   1.950693991817	  -0.617210041470	   0.686710558005
C 	   0.054706551989	  -2.402682156186	  -3.494992740536
Cl	   0.108007362553	  -0.985252544772	  -5.171067848335
C 	  -1.227119192896	  -2.553789259489	  -2.961302140865
C 	  -1.611644859495	  -3.808500299511	  -2.490530408627
C 	  -0.732325750211	  -4.874465852467	  -2.619529256851
C 	   0.516805142431	  -4.735743565030	  -3.221635045220
C 	   0.915521358674	  -3.486248426177	  -3.680159974405
H 	  -1.926306595833	  -1.716858971187	  -2.908818947382
H 	  -2.597395231983	  -3.956044291647	  -2.046552071678
H 	   1.173435001374	  -5.599873245227	  -3.331210688541
H 	   1.884702521767	  -3.357170334460	  -4.162980671142
O 	  -1.161317918953	  -6.137364261077	  -2.201475475505
S 	  -0.604281915294	  -6.790234902987	  -0.835492401556
O 	  -0.933011309010	  -8.186614918414	  -0.909139828455
O 	   0.714577279941	  -6.298494393765	  -0.530161143565
C 	  -1.771602273972	  -6.022290425361	   0.399560468956
F 	  -1.516254222285	  -4.732576452792	   0.509719405342
F 	  -3.016333347600	  -6.197024140320	   0.006803871408
F 	  -1.581377634123	  -6.613075410667	   1.561310834161
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.1, θ = 130), G = -5222.374458608029
Pd	   0.736893660033	  -0.519882697089	  -2.874153530078
P 	  -0.255916767727	   1.626520106983	  -2.362907879790
Cl	  -1.179835745223	   2.710889439790	  -3.901032358749
Cl	  -1.895476570371	   1.274638855971	  -1.103984003297
Cl	   0.699893741159	   3.177271895057	  -1.324741791390
P 	   2.517502997059	  -0.933280812522	  -1.420047204138
Cl	   4.065032839610	   0.435581975434	  -1.780217450602
Cl	   3.606761850342	  -2.724507641697	  -1.381263298249
Cl	   2.227498622110	  -0.622588219395	   0.633366791951
C 	   0.081161057004	  -2.408126026796	  -3.461569602787
Cl	   0.144394749653	  -0.995172870446	  -5.149571052994
C 	  -1.206272720879	  -2.545863036945	  -2.938335699173
C 	  -1.609809521292	  -3.796852466363	  -2.473938111258
C 	  -0.741863237506	  -4.872285413726	  -2.598487225008
C 	   0.514231810715	  -4.746630458285	  -3.188959778498
C 	   0.931058248937	  -3.500949148745	  -3.642410717169
H 	  -1.897886699568	  -1.702869405115	  -2.895048961238
H 	  -2.602270466341	  -3.935133102414	  -2.041973512556
H 	   1.159494300681	  -5.619376434932	  -3.297907905835
H 	   1.902211535104	  -3.383594339671	  -4.123807844516
O 	  -1.190293659373	  -6.131960986521	  -2.191609541591
S 	  -0.665242845773	  -6.790956134994	  -0.816093534512
O 	  -0.999529389514	  -8.185416344660	  -0.899767195968
O 	   0.649413543702	  -6.306021088384	  -0.482964826812
C 	  -1.853016620053	  -6.019956432279	   0.397471218249
F 	  -1.593384567730	  -4.731822731766	   0.515434440734
F 	  -3.090697101260	  -6.187490183689	  -0.019872230354
F 	  -1.688460063743	  -6.614172863464	   1.561334428139
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.1, θ = 140), G = -5222.372139631158
Pd	   0.764707699680	  -0.515678751889	  -2.841399076175
P 	  -0.292589234139	   1.629628512037	  -2.364808634589
Cl	  -1.231162166876	   2.677514453532	  -3.919177103570
Cl	  -1.917871706370	   1.295726276081	  -1.083022454887
Cl	   0.672010067436	   3.204180457470	  -1.371597541073
P 	   2.599128946670	  -0.890550656289	  -1.435552844930
Cl	   4.100046326567	   0.496152892992	  -1.907254881128
Cl	   3.724680169127	  -2.659350272859	  -1.408108861756
Cl	   2.403093316562	  -0.525264151180	   0.619961667019
C 	   0.098043015932	  -2.402594265530	  -3.418967671140
Cl	   0.171849764779	  -0.995223396774	  -5.116669412089
C 	  -1.192303307241	  -2.534607933455	  -2.901748311874
C 	  -1.609690016365	  -3.785951502305	  -2.450677395685
C 	  -0.752339332551	  -4.868754135905	  -2.583166084049
C 	   0.507963796516	  -4.748345857069	  -3.165641463068
C 	   0.938610398056	  -3.501808717139	  -3.604383676059
H 	  -1.878160825869	  -1.687409762165	  -2.856171239610
H 	  -2.606006006871	  -3.918968028194	  -2.026260341053
H 	   1.143721231111	  -5.626722797576	  -3.284610689238
H 	   1.910460935065	  -3.390700163075	  -4.085504420052
O 	  -1.218493020865	  -6.129189874980	  -2.198957917721
S 	  -0.706768229245	  -6.822313670609	  -0.835161181772
O 	  -1.044651218917	  -8.213318461289	  -0.953105631247
O 	   0.606483561167	  -6.349189854851	  -0.480612475365
C 	  -1.901727485435	  -6.074622137970	   0.385079514289
F 	  -1.655515719490	  -4.784704895961	   0.513128196225
F 	  -3.137661545678	  -6.251739370800	  -0.032876045422
F 	  -1.730266432766	  -6.676200501115	   1.544207598319
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.1, θ = 150), G = -5222.369060996990
Pd	   0.977022239077	  -0.557732909308	  -2.833926211466
P 	  -0.596728847505	   1.287872960094	  -2.159885114800
Cl	  -2.226487571023	   1.786199192145	  -3.381104754891
Cl	  -1.537021677338	   1.123907448844	  -0.293212287752
Cl	   0.327966469323	   3.160898126072	  -1.975075908925
P 	   2.868813042643	  -0.847672245160	  -1.494902970117
Cl	   4.207030851481	   0.686395336403	  -1.999426488514
Cl	   4.141211604422	  -2.511649180289	  -1.586186544007
Cl	   2.770155465130	  -0.566329724695	   0.580883406640
C 	   0.215358423792	  -2.402262568399	  -3.384087411225
Cl	   0.453131311476	  -0.992478094303	  -5.123195977497
C 	  -1.117690218411	  -2.516213319869	  -2.989024905289
C 	  -1.589501734314	  -3.760186546151	  -2.576360711374
C 	  -0.735705465591	  -4.854525097839	  -2.622649409890
C 	   0.570949361099	  -4.753266650191	  -3.091673941831
C 	   1.052535743760	  -3.512206288916	  -3.497406298592
H 	  -1.791105719440	  -1.659459458917	  -3.009806347827
H 	  -2.622159912273	  -3.881103387424	  -2.245252179925
H 	   1.204125903820	  -5.639306915606	  -3.151501016123
H 	   2.061270510933	  -3.418136439498	  -3.898822116254
O 	  -1.252419732056	  -6.103054714175	  -2.266212040842
S 	  -0.873836840684	  -6.782280924638	  -0.853037479770
O 	  -1.362833444036	  -8.130309110580	  -0.930910965416
O 	   0.471906905701	  -6.445569727156	  -0.464854443466
C 	  -2.016012052836	  -5.848385629712	   0.292101354213
F 	  -1.567250554557	  -4.620795826763	   0.465118348346
F 	  -3.229335138189	  -5.811528305936	  -0.219746275026
F 	  -2.037795944497	  -6.480826564922	   1.447100313972
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.1, θ = 160), G = -5222.365234379566
Pd	   1.006876533595	  -0.559562514327	  -2.744156188846
P 	  -0.599244449644	   1.398293813203	  -2.252023306371
Cl	  -2.278342459463	   1.723490713497	  -3.464536665309
Cl	  -1.443010185164	   1.597518627801	  -0.342986429585
Cl	   0.373651670541	   3.245849885066	  -2.444093720783
P 	   2.946998299633	  -0.790365745213	  -1.461509708309
Cl	   4.127484643306	   0.896969163632	  -1.860395284203
Cl	   4.352301261958	  -2.310124746896	  -1.795806690194
Cl	   2.935808040430	  -0.735440554611	   0.634859031294
C 	   0.227755225901	  -2.390871748113	  -3.312344394188
Cl	   0.455838000253	  -0.987772653035	  -5.033354254943
C 	  -1.091184025863	  -2.490161693656	  -2.869081720898
C 	  -1.574320937815	  -3.734203376824	  -2.468227145341
C 	  -0.747967896725	  -4.844212678318	  -2.576320292959
C 	   0.546796475215	  -4.754871936280	  -3.080361425216
C 	   1.041183838235	  -3.514037361015	  -3.469201996873
H 	  -1.750191717889	  -1.623008507690	  -2.849479979195
H 	  -2.597209365941	  -3.841666388613	  -2.104528270633
H 	   1.156626014775	  -5.652805639462	  -3.187544652668
H 	   2.037172772360	  -3.429987364023	  -3.902749439425
O 	  -1.282438366997	  -6.095721202468	  -2.259198684380
S 	  -0.894924470563	  -6.842805283396	  -0.883816797478
O 	  -1.306843166555	  -8.208224636670	  -1.053078524573
O 	   0.420982427933	  -6.456517634175	  -0.443937174835
C 	  -2.114775408537	  -6.048035125521	   0.283025044379
F 	  -1.755706083676	  -4.800205779882	   0.514247122134
F 	  -3.320652921850	  -6.072277446125	  -0.246377142635
F 	  -2.107070767579	  -6.729248753782	   1.409920314358
28
TS_CCl-PdL2 (VL_PR3, r0 = 2.1, θ = 170), G = -5222.359775364041
Pd	   1.044820769240	  -0.583745522860	  -2.673277549711
P 	  -0.687808983319	   1.390793224192	  -2.238686824987
Cl	  -2.328242401218	   1.695164773011	  -3.508077585378
Cl	  -1.571457594326	   1.668920963616	  -0.357705834434
Cl	   0.311122916267	   3.220326044830	  -2.467226730530
P 	   3.069012291303	  -0.761306292764	  -1.472939035155
Cl	   4.175048688464	   0.968240258157	  -1.903934464420
Cl	   4.502306183306	  -2.231486958538	  -1.896855200181
Cl	   3.160280395832	  -0.721256704104	   0.621911817365
C 	   0.242159927910	  -2.390263816119	  -3.274323396416
Cl	   0.487987241418	  -0.985336985237	  -4.972341280814
C 	  -1.080781348458	  -2.491448010422	  -2.840603953787
C 	  -1.573263182581	  -3.736207734991	  -2.455082817603
C 	  -0.752584039147	  -4.849673005346	  -2.567465473114
C 	   0.546207442166	  -4.761199840635	  -3.060625695800
C 	   1.049197841329	  -3.518828104473	  -3.434007210895
H 	  -1.738239640261	  -1.624197637807	  -2.821299509500
H 	  -2.599928461321	  -3.842407025594	  -2.101817012985
H 	   1.150754147692	  -5.661762649602	  -3.174771574371
H 	   2.046152891120	  -3.437027724180	  -3.865108920949
O 	  -1.298191279486	  -6.101551383577	  -2.269959695338
S 	  -0.935491027521	  -6.863354616284	  -0.896352837585
O 	  -1.361407601713	  -8.222544283596	  -1.080740697977
O 	   0.379772746408	  -6.495784098835	  -0.439066129261
C 	  -2.157716299617	  -6.064617238894	   0.265295324643
F 	  -1.789553339596	  -4.821486110943	   0.507566430345
F 	  -3.359617874977	  -6.075081295861	  -0.273531415139
F 	  -2.164947429037	  -6.752884790041	   1.387968896301
