15
Conformer name: O1 Relative energy: 0 kcal/mol
C  -0.7272898431   0.3577772221   0.0015569158
C   0.6166176607   0.0522407411   0.6626483761
N  -1.7420355416   0.0244655762   0.9995501490
H  -2.4569611613   0.7448024146   1.0881481169
H  -2.2048415716  -0.8667605333   0.8142909502
H  -0.7205790123   1.4474962187  -0.1800825752
C  -0.8407171867  -0.3478469829  -1.3585582680
H  -1.7757294271  -0.0439770395  -1.8522417812
H  -0.8231526851  -1.4446224690  -1.2342398225
O   0.3101116551   0.1098886812  -2.1026243411
O   0.6131485701  -0.1635942096   1.9225966550
H   0.3438092189  -0.3143623374  -2.9746753903
O   1.7266128992   0.0170182360   0.0247389089
H   1.5019220268   0.1082378557  -0.9547863292
H  -0.3817929588  -0.1292991025   2.1426073933
15
Conformer name: O2 Relative energy: 5.87 kcal/mol
C  -0.4218164554  -0.7980951956  -0.1518993457
C  -0.0986933212   0.2234012011   0.9234314230
N   0.7410217605  -1.6482241032  -0.3728507486
H   1.5620617612  -1.1356052097  -0.6946563749
H   0.9815229027  -2.2239484860   0.4331429443
H  -1.2594896152  -1.4161539137   0.2042018670
C  -0.8231329287  -0.0958476308  -1.4506317706
H  -1.7688448474   0.4567088495  -1.3320584784
H  -0.9092819040  -0.8496654024  -2.2452314912
O   0.2690570211   0.8250710491  -1.7459985056
O  -0.3047476946  -0.1163829028   2.1575611435
H   0.0847111465   1.3291357551  -2.5546713079
O   0.4454249385   1.3539148085   0.6630168564
H   0.4979652636   1.4210815777  -0.3703740152
H   0.0213485860   0.5727479710   2.7761357695
15
Conformer name: O3 Relative energy: 6.27 kcal/mol
C  -0.4228277255  -0.7989389158  -0.1541503039
C  -0.0942408774   0.2218516459   0.9201064112
N   0.8187171241  -1.5676788485  -0.2326413441
H   0.6518581242  -2.5698304784  -0.2844861215
H   1.4069725179  -1.2722373637  -1.0108993295
H  -1.2439318226  -1.4266079338   0.2211961681
C  -0.8492849240  -0.1011152741  -1.4495329136
H  -1.7786179746   0.4754355916  -1.3102449189
H  -0.9857022329  -0.8524689918  -2.2408459508
O   0.2579117993   0.7857327698  -1.7797353792
O  -0.3443817368  -0.0908322524   2.1477021038
H   0.0619960417   1.2950202902  -2.5821898364
O   0.4796760548   1.3358749238   0.6519252674
H   0.5494992260   1.3944664755  -0.3701282373
H   0.0012246449   0.5877376692   2.7671120850
15
Conformer name: O4 Relative energy: 6.35 kcal/mol
C  -0.7619856491   0.3423008009  -0.0192366387
C   0.5343749772   0.0489898475   0.7322304932
N  -1.9850143706  -0.0534759205   0.6315325177
H  -1.9845087060  -1.0246867095   0.9403397180
H  -2.2327291635   0.5431050911   1.4181149226
H  -0.7568844859   1.4421083438  -0.1445855593
C  -0.7092896628  -0.2842260505  -1.4260501231
H  -1.5600546274   0.0942939468  -2.0061660858
H  -0.7535610622  -1.3841257825  -1.3648234052
O   0.5481882601   0.1454538777  -2.0239857436
O   0.4714199529  -0.0460573328   2.0229332107
H   0.6815671391  -0.2751626842  -2.8887838700
O   1.6597057772  -0.0821417578   0.1424812286
H   1.4631074982  -0.0066278911  -0.8855294680
H   1.3622772998  -0.1954979115   2.4075315820
15
Conformer name: O5 Relative energy: 6.41 kcal/mol
C  -0.4496114779  -0.8098406385  -0.1299286945
C  -0.0753648063   0.2113373233   0.9285271211
N   0.7790104540  -1.5753709234  -0.3955720410
H   1.1152389789  -2.0491532599   0.4460074463
H   0.5685409964  -2.3201357756  -1.0651073798
H  -1.3122880360  -1.3920014855   0.2413051564
C  -0.8317152654  -0.0595269047  -1.4188474250
H  -1.7458776076   0.5362404590  -1.2930727752
H  -0.9722704715  -0.7683267180  -2.2473629660
O   0.2208030178   0.8959560721  -1.7520337658
O  -0.2854444103  -0.1165540060   2.1674599908
H   0.9916408880   0.3984865851  -2.0825452070
O   0.4533843661   1.3250099415   0.6285653963
H   0.4999137844   1.3348981663  -0.4580816456
H   0.0258875711   0.5891578626   2.7753346202
15
Conformer name: O6 Relative energy: 6.87 kcal/mol
C  -0.7480067543   0.3708964238  -0.0182797874
C   0.5326760532   0.0485305772   0.7181508793
N  -1.8925842615  -0.1191496384   0.7315988992
H  -1.9662057697   0.3323936989   1.6441873603
H  -2.7554638060   0.0977076969   0.2301715591
H  -0.6964569510   1.4721150553  -0.1747639113
C  -0.7227300554  -0.3028583435  -1.4031095921
H  -1.5950285953   0.0271968999  -1.9849792460
H  -0.7350018365  -1.3980720975  -1.2910853052
O   0.5025998726   0.1474210005  -2.0458432602
O   0.4780334161  -0.0521222799   2.0062384635
H   0.6265281355  -0.3030636919  -2.8970656743
O   1.6517207094  -0.0786768332   0.1155983191
H   1.4491814433  -0.0006057427  -0.9059284145
H   1.3664600837  -0.2248473758   2.3866868421
15
Conformer name: O7 Relative energy: 7.1 kcal/mol
C  -0.7627966881   0.3280249434  -0.0134938750
C   0.5391459313   0.0458468422   0.7219482700
N  -1.8994828898  -0.0146994102   0.8062245246
H  -2.1497242548  -1.0015452976   0.7545690387
H  -2.7172274085   0.5454443269   0.5764416038
H  -0.7410397168   1.4262645116  -0.1560390462
C  -0.7252095533  -0.3234812974  -1.4131533544
H  -1.6098680720   0.0026953916  -1.9775724122
H  -0.7186029627  -1.4234132441  -1.3295888510
O   0.4886394685   0.1501674510  -2.0600596660
O   1.6570890951  -0.0505343964   0.1036723711
H   0.6106297109  -0.2767228729  -2.9235786924
O   0.5103346300  -0.0677639090   2.0066737525
H   1.4161280024  -0.2028531657   2.3615156841
H   1.4519301488   0.0280556918  -0.9100878595
15
Conformer name: O8 Relative energy: 7.31 kcal/mol
C  -0.7669261363   0.3617763092   0.0056855899
C   0.5432736194   0.0611848506   0.7292349526
N  -1.9797691737  -0.0505726342   0.6638680055
H  -2.2143474200   0.5186487481   1.4744857851
H  -1.9781129207  -1.0324540428   0.9374889747
H  -0.7711867509   1.4640494691  -0.0958763744
C  -0.7315930531  -0.2564939772  -1.4120972758
H  -1.5692179080   0.1441914961  -1.9955986804
H  -0.8227144602  -1.3509232054  -1.3541368716
O   0.5434195879   0.0120797646  -2.0656778244
O   0.5024172225  -0.0772253151   2.0168876918
H   0.4729953815   0.7781962045  -2.6573348504
O   1.6591719118  -0.0362870938   0.1158270551
H   1.4393368527   0.0431899262  -0.9102555192
H   1.4003189527  -0.2357323424   2.3812731868
15
Conformer name: O9 Relative energy: 7.46 kcal/mol
C  -0.4154135820  -0.8099607715  -0.1348010072
C  -0.0893408333   0.2266645557   0.9211583883
N   0.7519315574  -1.6674680723  -0.3360272292
H   1.6163094947  -1.1498202606  -0.4979713902
H   0.9018070844  -2.3146215116   0.4381723808
H  -1.2523137680  -1.4258323711   0.2262394716
C  -0.8187239303  -0.1157888407  -1.4425545789
H  -1.7723327600   0.4202432576  -1.3326380824
H  -0.8995107223  -0.8699507568  -2.2362666090
O   0.1774958006   0.8934992968  -1.7840690960
O   0.5043519977   1.3245711054   0.6318875539
H   0.7910027480   0.5616782514  -2.4577258013
O  -0.3426007261  -0.0588264801   2.1597698856
H  -0.0152440580   0.6447513322   2.7616176560
H   0.5672514999   1.3613914681  -0.4061916073
15
Conformer name: O10 Relative energy: 7.98 kcal/mol
C  -0.7547686194   0.3879709040   0.0059026340
C   0.5415793519   0.0600747557   0.7126856790
N  -1.8813961662  -0.1193964757   0.7690263902
H  -1.9512346110   0.3239840654   1.6858327988
H  -2.7555580332   0.0794089224   0.2799895248
H  -0.7138524913   1.4930074128  -0.1297626513
C  -0.7458553011  -0.2774035211  -1.3905626281
H  -1.6100105651   0.0667922663  -1.9751111006
H  -0.7924919393  -1.3694279424  -1.2814417911
O   0.4956727675   0.0195063796  -2.0869536949
O   0.5105267777  -0.0750925938   1.9983530762
H   0.3981599993   0.8016593730  -2.6533993100
O   1.6501618954  -0.0422127120   0.0866768585
H   1.4263711903   0.0395839239  -0.9322276892
H   1.4061275728  -0.2568704042   2.3574909022
15
Conformer name: O11 Relative energy: 8.17 kcal/mol
C  -0.7689645314   0.3483762781   0.0141929873
C   0.5497440694   0.0585498430   0.7154858889
N  -1.8873137586  -0.0198033003   0.8491308655
H  -2.7155430989   0.5345972904   0.6438391517
H  -2.1280149489  -1.0084758933   0.7823702449
H  -0.7604761279   1.4499651815  -0.0997692878
C  -0.7543499101  -0.2907986151  -1.3983712339
H  -1.6274859364   0.0615518100  -1.9637770256
H  -0.7958960854  -1.3875769191  -1.3198878238
O   0.4816836023   0.0177899460  -2.1032634887
O   0.5481357717  -0.0935314503   1.9966324403
H   0.3634617750   0.7793939683  -2.6929525228
O   1.6543483666  -0.0106593889   0.0707523247
H   1.4240872771   0.0716891611  -0.9399214680
H   1.4613267685  -0.2382977399   2.3281790429
15
Conformer name: O12 Relative energy: 9.92 kcal/mol
C  -0.4172071647  -0.7970739907  -0.1597562948
C  -0.0932812264   0.2103932960   0.9389601382
N   0.7449245366  -1.6348113765  -0.4225668121
H   1.5474946365  -1.1061745313  -0.7651319367
H   1.0270542873  -2.2191937671   0.3632705050
H  -1.2543733245  -1.4332534047   0.1725200984
C  -0.8410193091  -0.0717763838  -1.4410601123
H  -1.7753869020   0.4925991420  -1.2894939588
H  -0.9635789506  -0.8189091740  -2.2377588003
O   0.2566318374   0.8287587199  -1.7524704227
O   0.4635920994   1.3313379299   0.6840752990
H   0.0644461390   1.3389769016  -2.5553398628
O  -0.2602801543  -0.0319330337   2.2055072133
H  -0.7125192843  -0.8828061547   2.3579259446
H   0.5193505754   1.4120015734  -0.3367126186
15
Conformer name: O13 Relative energy: 11.02 kcal/mol
C  -0.7716404983   0.3316400847  -0.0178547809
C   0.5359181419   0.0460502356   0.7323102254
N  -1.9347766174  -0.0451863010   0.6974556586
H  -2.2063538770  -1.0132177536   0.7833149864
H  -2.5586368862   0.6529933402   1.0688874891
H  -0.7571238628   1.4307328067  -0.1479278725
C  -0.7131486687  -0.2974081383  -1.4268661176
H  -1.5738706004   0.0665205835  -2.0027687923
H  -0.7409433200  -1.3980150987  -1.3619938457
O   0.5318098270   0.1482990455  -2.0368363569
O   0.4849532969  -0.0559831012   2.0192465043
H   0.6635668955  -0.2744404254  -2.9008056037
O   1.6618068463  -0.0674236360   0.1343078847
H   1.4663460531   0.0080380995  -0.8854829372
H   1.3825648832  -0.1964843253   2.3913307526
15
Conformer name: O14 Relative energy: 11.56 kcal/mol
C  -0.4117097307  -0.8090519452  -0.1453856886
C  -0.0859984957   0.2124689508   0.9359148632
N   0.7578184404  -1.6516790686  -0.3855271537
H   0.9425527533  -2.3150832337   0.3666857693
H   1.6094260882  -1.1178669235  -0.5623176321
H  -1.2466831041  -1.4460279422   0.1894676812
C  -0.8354039795  -0.0915014454  -1.4367562423
H  -1.7804119182   0.4535688335  -1.2963346502
H  -0.9473711881  -0.8402974272  -2.2320709982
O   0.1687694703   0.8983670329  -1.7842057771
O  -0.2963908255   0.0224547642   2.2045105084
H   0.7278351675   0.5895161621  -2.5130805389
O   0.5206303520   1.3016942607   0.6567926632
H   0.5923866364   1.3561287565  -0.3657960173
H  -0.7811530804  -0.8069378453   2.3744008495
15
Conformer name: O15 Relative energy: 16.02 kcal/mol
C   0.7275241515   0.4277376053  -0.4341725042
C   0.1224308643   0.0513176189   0.9109124932
N   0.2158737908   1.6300207270  -1.0294914018
H  -0.7841065055   1.5678692922  -1.2186719896
H   0.4115311317   2.4708884340  -0.4899270356
H   1.8183791000   0.5175071134  -0.2754239120
C   0.4456987918  -0.7826692693  -1.3497001791
H   1.0211655842  -1.6750510625  -1.0393528139
H   0.7437987191  -0.4968259667  -2.3696569287
O  -0.9612675964  -0.9906716839  -1.2123344821
O   0.5354833380  -0.9321266753   1.6508198463
H  -1.2754071599  -1.6075503442  -1.8902504481
O  -0.8631663811   0.7394425918   1.3591392203
H  -1.1954205195   0.3886078069   2.2150267804
H   1.2806755137  -1.4149846851   1.2426191903
15
Conformer name: O16 Relative energy: 16.26 kcal/mol
C   0.7264752947   0.4289576085  -0.4260550349
C   0.1213040175   0.0358185915   0.9043437394
N   0.1851031208   1.7055007948  -0.8332126722
H   0.8162970475   2.1752390565  -1.4798465413
H  -0.7216304590   1.5921812344  -1.2885509435
H   1.8154637386   0.5218221143  -0.2609608270
C   0.4504279800  -0.7672542151  -1.3697550866
H   1.0145992709  -1.6714735678  -1.0692377766
H   0.7675008219  -0.4770366351  -2.3842459360
O  -0.9583799508  -0.9630876367  -1.2598195544
O  -0.8769690049   0.6967162709   1.3544565396
H  -1.2638262374  -1.5914657591  -1.9311408504
O   0.5396600387  -0.9652943615   1.6189502167
H   1.3039269579  -1.4185115519   1.2135362213
H  -1.2075840420   0.3241115637   2.2017320208
15
Conformer name: O17 Relative energy: 17.6 kcal/mol
C   0.7466129569   0.4559434260  -0.4223473926
C   0.1377604091   0.0470360215   0.8892700720
N   0.0882733239   1.6497366995  -0.9212504494
H   0.2060380577   2.4540400495  -0.3034936222
H   0.4939607267   1.9085360840  -1.8217853559
H   1.8447265143   0.5219561634  -0.2606489158
C   0.4153786597  -0.7278815645  -1.3769711022
H   1.0325845076  -1.6116388095  -1.1497293794
H   0.6470546680  -0.4119632870  -2.4076396247
O  -0.9378775831  -1.1140373926  -1.1951925898
O  -0.8328921091   0.7315256173   1.3729639979
H  -1.5075658297  -0.4409012301  -1.6008440512
O   0.5402074061  -0.9751998255   1.5761063074
H   1.2694757016  -1.4572843042   1.1388863909
H  -1.1681317057   0.3433879264   2.2118295078
15
Conformer name: O18 Relative energy: 19.32 kcal/mol
C   0.7269965836   0.4265010767  -0.4253420822
C   0.1144545615   0.0482496294   0.9022606995
N   0.1917651656   1.6994447612  -0.8548074349
H   0.8390723468   2.1643784517  -1.4885751192
H  -0.7000143512   1.5792511575  -1.3369512211
H   1.8140260136   0.5036024710  -0.2519841335
C   0.4449933127  -0.7883906399  -1.3411767135
H   1.0126215084  -1.6751735204  -1.0127081243
H   0.7394792198  -0.5155544707  -2.3669019944
O  -0.9683734925  -0.9830168667  -1.2083718959
O  -0.8998171935   0.7154055743   1.3232866358
H  -1.2718561000  -1.6489571176  -1.8430314973
O   0.6492616644  -0.9583948251   1.5205612853
H   0.2075784443  -1.2242219418   2.3519087289
H  -1.2870055989   0.3988709183   2.1652802633
15
Conformer name: O19 Relative energy: 19.58 kcal/mol
C   0.4588313670   0.1564093996  -0.2983889948
C   0.0676252898  -0.0995043999   1.1279049364
N   0.3528894608   1.5599984430  -0.6151261176
H   1.1660523311   2.0894479352  -0.3006317469
H   0.2993433643   1.6570701010  -1.6305847662
H   1.4583292101  -0.3082164466  -0.4446295799
C  -0.5421925677  -0.6437666392  -1.1805779710
H  -1.5487588995  -0.2097657014  -1.0473132224
H  -0.5528379824  -1.7101433783  -0.8882773995
O  -0.0440455305  -0.4622416366  -2.4946038022
O  -0.6524251174   0.7579369405   1.7536230754
H  -0.7034215444  -0.7720553400  -3.1338124232
O   0.3860811680  -1.1850552746   1.7666522417
H   0.9580240066  -1.7708899276   1.2308663962
H  -0.8661696778   0.4566527592   2.6649295906
15
Conformer name: O20 Relative energy: 19.73 kcal/mol
C   0.7276728649   0.4272314280  -0.4408855017
C   0.1164774863   0.0768063908   0.9053744996
N   0.2196450537   1.6132282995  -1.0695416319
H  -0.7768864468   1.5502217942  -1.2729632661
H   0.4177574408   2.4717956149  -0.5605538767
H   1.8165925576   0.5062737125  -0.2777728558
C   0.4404860872  -0.8157943734  -1.3106038214
H   1.0283695740  -1.6819202025  -0.9665366528
H   0.7048578314  -0.5589213080  -2.3471002928
O  -0.9678503955  -1.0300033297  -1.1354301130
O  -0.9034370060   0.7541323530   1.3079199826
H  -1.2777876263  -1.7038293310  -1.7585443721
O   0.6613627633  -0.8965472222   1.5640724094
H   0.2263017520  -1.1360275404   2.4074670204
H  -1.2941174548   0.4596347620   2.1562842685
15
Conformer name: O21 Relative energy: 19.78 kcal/mol
C   0.4752450246   0.6318097531  -0.4270601622
C   0.0114634170  -0.0938340908   0.8206672896
N   0.1167420980   2.0301926315  -0.2591754820
H   0.8486842882   2.6502314245  -0.5975569371
H  -0.7613708611   2.2700810719  -0.7173116096
H   1.5674166889   0.5122845985  -0.4506562146
C  -0.1547415595  -0.1207467384  -1.6084897426
H   0.3637613281   0.1583572818  -2.5389184784
H  -1.2252774306   0.1400990637  -1.6877433401
O   0.0281138225  -1.4993839838  -1.2637660618
O  -1.2528024421  -0.0567674732   1.0788694867
H  -0.2874591478  -2.0670425121  -1.9822507521
O   0.9024483104  -0.6627925693   1.5580221677
H   0.5621575917  -1.1180391976   2.3559991133
H  -1.5310096268  -0.5080157837   1.9009180399
15
Conformer name: O22 Relative energy: 20.28 kcal/mol
C   0.4972570432   0.5190248884  -0.5636902908
C   0.0298757511   0.1165988127   0.8253980074
N   0.1604390800   1.8637484600  -0.9575320090
H  -0.8361228012   2.0709857960  -0.9242000847
H   0.6906812408   2.5848484368  -0.4735179614
H   1.5889896874   0.3873437017  -0.5622207970
C  -0.1491887148  -0.5107307768  -1.5083255405
H   0.4115024422  -0.5252634158  -2.4542684814
H  -1.1967665456  -0.2210078245  -1.7018595400
O  -0.0669114778  -1.7490338220  -0.7900491997
O  -1.2173313697   0.3142282250   1.1068944380
H  -0.3912732592  -2.4733149362  -1.3449295385
O   0.9026698678  -0.3661892092   1.6430037374
H   0.5571514671  -0.6510890406   2.5145581562
H  -1.5005612919   0.0277491168   1.9984280176
15
Conformer name: O23 Relative energy: 20.58 kcal/mol
C   0.4169304111   0.1647312103  -0.3115223727
C   0.0657011714  -0.1161767105   1.1192979784
N   0.4844096458   1.5973207004  -0.5211660040
H   0.9722495073   1.7765756617  -1.3994749852
H  -0.4486841370   2.0035214425  -0.6155735534
H   1.4179782785  -0.2670285609  -0.4915539028
C  -0.5789097880  -0.6250574470  -1.2093753809
H  -1.5839608974  -0.1742365238  -1.1132531248
H  -0.6310297752  -1.6896226629  -0.9079138629
O  -0.0338581812  -0.4692446781  -2.5071954460
O  -0.7113796310   0.7042181635   1.7290961171
H  -0.6544733132  -0.8204437640  -3.1633063811
O   0.4420237530  -1.1705183548   1.7741092626
H   1.0577907777  -1.7277856454   1.2576452252
H  -0.9010870220   0.4221480441   2.6513298990
15
Conformer name: O24 Relative energy: 20.61 kcal/mol
C   0.4417241826   0.1992244769  -0.2921650866
C   0.0812673858  -0.1084807929   1.1317851082
N   0.4355222158   1.5864111513  -0.6821949034
H   1.2206078949   2.1207576941  -0.3140794180
H  -0.4362940835   2.0645226083  -0.4545346410
H   1.4346215962  -0.2405822577  -0.4903322642
C  -0.5765470659  -0.5803554135  -1.2034395802
H  -1.5598880284  -0.0797761550  -1.1168274896
H  -0.6823091334  -1.6281229432  -0.8798158768
O  -0.0846317575  -0.6077465191  -2.5147587420
O  -0.6870879720   0.7065447354   1.7684636454
H  -0.0204037890   0.3069312381  -2.8356681341
O   0.4263510949  -1.1935957994   1.7554727326
H   1.0194209528  -1.7571323672   1.2184731158
H  -0.9075797316   0.3805806456   2.6691807249
15
Conformer name: O25 Relative energy: 20.75 kcal/mol
C   0.5204763871   0.1311234309  -0.2754420603
C   0.0663442403  -0.0751905288   1.1366364824
N   0.4380759426   1.5220458092  -0.6414739249
H   1.2620169583   2.0517479202  -0.3595826007
H   0.3483900288   1.5929517513  -1.6567338105
H   1.5178093707  -0.3500281495  -0.3713520488
C  -0.4985318752  -0.6765381987  -1.1677333235
H  -1.5012995753  -0.2590280164  -0.9896386368
H  -0.4884851337  -1.7467507042  -0.8988670527
O  -0.1949301518  -0.4482858055  -2.5248687900
O  -0.7804110125   0.7394344768   1.6530009480
H   0.4423573313  -1.1059182050  -2.8410182458
O   0.4227403185  -1.0948186522   1.8616692935
H   1.0928650842  -1.6471556626   1.4124090712
H  -1.0417638073   0.4655984871   2.5602928050
15
Conformer name: O26 Relative energy: 21.06 kcal/mol
C   0.7513212038   0.4486748356  -0.4308506659
C   0.1288887604   0.0864456849   0.8844956902
N   0.1006218850   1.6221650254  -0.9866389876
H   0.2802877660   2.4658742846  -0.4403459006
H   0.4712513275   1.7990067715  -1.9213059172
H   1.8463747871   0.5033511421  -0.2661509352
C   0.4147960918  -0.7884257272  -1.3167973881
H   1.0332701187  -1.6470547723  -1.0234763334
H   0.6314438928  -0.5295683119  -2.3660572170
O  -0.9428231279  -1.1618447848  -1.1033774101
O  -0.8953764201   0.7517659537   1.2930848955
H  -1.5126812163  -0.5249317921  -1.5627951326
O   0.6724536804  -0.9028555582   1.5181455860
H   0.2171924222  -1.1803888111   2.3382724861
H  -1.2928964454   0.4306871482   2.1288313065
15
Conformer name: O27 Relative energy: 21.59 kcal/mol
C   0.3897480253  -0.3204047539  -0.2740458700
C  -0.1282975059  -0.1176318245   1.1273646824
N   1.3144841215   0.8142887349  -0.3865831977
H   2.2876938364   0.5284193239  -0.2873042801
H   1.2138702803   1.2385002838  -1.3114175830
H   0.8793198967  -1.3097370074  -0.3372092323
C  -0.7415938607  -0.2215038398  -1.3219657356
H  -1.2776299787   0.7285587473  -1.1797048463
H  -1.4537917705  -1.0533542941  -1.1979997827
O  -0.1618514395  -0.1748011684  -2.6144834584
O  -1.1553913800   0.6348161856   1.3050300776
H  -0.0985385979  -1.0676455129  -2.9830164934
O   0.4376892916  -0.5953639463   2.1923197439
H   1.2043387348  -1.1634733385   1.9816863871
H  -1.3387637591   0.7908598974   2.2575824361
15
Conformer name: O28 Relative energy: 21.83 kcal/mol
C   0.7336742730  -0.4006030864  -0.1708259445
C  -0.2058745742  -0.1027788799   0.9708524118
N   1.3834264357   0.9103193170  -0.2508885965
H   2.3971474176   0.8427115806  -0.3056868551
H   1.0093480010   1.4419825967  -1.0381859433
H   1.4350792775  -1.1650316086   0.1935514417
C   0.0578539776  -0.8816520906  -1.4567424822
H  -0.5999229179  -1.7441402349  -1.2456493278
H   0.8602333449  -1.2068067183  -2.1405394892
O  -0.6671335567   0.2295664722  -1.9774393126
O   0.2199914301  -0.4011996461   2.1583060008
H  -0.9603061976   0.0251410765  -2.8770436224
O  -1.3280201984   0.4845840737   0.7212058227
H  -1.8328500444   0.7683445605   1.5105989669
H  -0.3343983263  -0.0753152742   2.8961473088
15
Conformer name: O29 Relative energy: 22.69 kcal/mol
C   0.2368904823   0.3739866980  -0.2834516329
C   0.1119309774  -0.1238945029   1.1323338464
N  -0.7874495743   1.3856808481  -0.5296111734
H  -1.7419288843   1.0753518419  -0.3440651550
H  -0.6128181101   2.2757738830  -0.0645792924
H   1.2277321632   0.8412870175  -0.3820698916
C   0.1018422535  -0.7578559507  -1.3203904984
H  -0.9229053452  -1.1936592460  -1.2675218492
H   0.8331897400  -1.5568230408  -1.1198310498
O   0.3805612763  -0.2654946879  -2.6058895961
O   0.7689083584   0.4869611974   2.0571768546
H  -0.2210347782   0.4752437762  -2.7878162509
O  -0.6742623499  -1.0863798249   1.5090924228
H  -1.1026589792  -1.5275549882   0.7466558866
H   0.5696884968   0.1342498664   2.9531127137
15
Conformer name: O30 Relative energy: 22.95 kcal/mol
C   0.3728811152   0.2874128623  -0.3132285711
C   0.0708371801  -0.1686461585   1.0972700081
N   0.4070615925   1.7040918050  -0.5332939248
H   1.1957629343   2.1758571622  -0.0962752609
H  -0.4613359920   2.1806481992  -0.2969251617
H   1.3549995905  -0.1495921985  -0.5752873849
C  -0.6563195614  -0.4066840814  -1.2545410025
H  -1.5240128135   0.2673695292  -1.3610965354
H  -1.0089448200  -1.3672001677  -0.8279717791
O   0.0431421948  -0.6082337771  -2.4662276594
O  -0.5977765642   0.6092592967   1.8745473833
H  -0.5891565558  -0.7074023104  -3.1932678470
O   0.4124814577  -1.3238574593   1.5793668160
H   0.9267684365  -1.8533878290   0.9363307108
H  -0.7608729554   0.2017583656   2.7540831861
15
Conformer name: O31 Relative energy: 23.19 kcal/mol
C   0.7321423452  -0.4141462486  -0.1662694234
C  -0.2087331344  -0.1036199682   0.9721660618
N   1.4948386099   0.7998314440  -0.4095317151
H   0.9322440345   1.5452030258  -0.8182169709
H   2.0699403347   1.1201983326   0.3665939741
H   1.4042409672  -1.2110316037   0.1864807530
C   0.0275639176  -0.8604391443  -1.4475689747
H  -0.6269478761  -1.7266835027  -1.2429650633
H   0.8225790085  -1.1633613058  -2.1479029951
O  -0.7100854230   0.2616715937  -1.9269422939
O   0.2514832115  -0.3275381913   2.1685432139
H  -0.9413531011   0.1143429205  -2.8550432420
O  -1.3569405741   0.4396806731   0.7300387994
H  -1.8625035298   0.7151918586   1.5224128519
H  -0.3178527536  -0.0190709629   2.9028635408
15
Conformer name: O32 Relative energy: 23.21 kcal/mol
C   0.3758365547  -0.1972633086  -0.3113023222
C  -0.1346831529  -0.1298506922   1.1029172789
N   1.4212731274   0.8046281682  -0.4369741986
H   1.1155039780   1.7620867326  -0.2713851095
H   2.2937765872   0.5997502318   0.0447951560
H   0.8122753524  -1.1948571024  -0.4862878762
C  -0.7505515874   0.0114321677  -1.3339414935
H  -1.0277189825   1.0806702289  -1.3596013157
H  -1.6382369419  -0.5780891545  -1.0352904965
O  -0.2001131838  -0.4412833517  -2.5561948300
O  -0.9906955157   0.7896524982   1.4019989337
H  -0.7929020350  -0.2029687542  -3.2836768547
O   0.2981151475  -0.8614043060   2.0853970243
H   0.9135754960  -1.5577320817   1.7808416747
H  -1.1865652280   0.8151153980   2.3642322347
15
Conformer name: O33 Relative energy: 23.98 kcal/mol
C   0.4535139731   0.1649848380  -0.2862690358
C   0.0641587207  -0.1082762905   1.1356694018
N   0.2995821440   1.5674080314  -0.5970388418
H   1.1168002061   2.1109897680  -0.3196438584
H   0.2086876146   1.6589013273  -1.6102745126
H   1.4657856961  -0.2690430369  -0.4140222651
C  -0.5050223030  -0.6753869710  -1.1782022055
H  -1.5398924550  -0.3197042439  -1.0229765682
H  -0.4233290295  -1.7432702353  -0.9137973059
O  -0.0460642164  -0.4148606702  -2.4946635009
O  -0.5792235691   0.7956855543   1.7917427473
H  -0.6697507311  -0.7958083859  -3.1308594125
O   0.3891509644  -1.2721559756   1.6095498246
H   0.1016736487  -1.4513290559   2.5277310217
H  -0.8255379832   0.5488268679   2.7073856514
15
Conformer name: O34 Relative energy: 24.04 kcal/mol
C   0.3592529701  -0.2983107727  -0.2851696516
C  -0.1430828563  -0.1253194829   1.1199445762
N   1.2626356968   0.8627234688  -0.3325428812
H   1.1892325299   1.3091147615  -1.2486831466
H   2.2335119147   0.5822862671  -0.1973605710
H   0.8690022864  -1.2711310140  -0.3686068485
C  -0.7543150395  -0.1967767447  -1.3300495910
H  -1.2973024395   0.7570647409  -1.2114595987
H  -1.4601645401  -1.0364433545  -1.2053594136
O  -0.0565427748  -0.2564566595  -2.5673539706
O   0.5711124213  -0.6576539999   2.0589613368
H  -0.6914147385  -0.1928713134  -3.2958687592
O  -1.1997877277   0.5925359309   1.3162927695
H  -1.4053401094   0.7912695501   2.2525645923
H   0.3058898393  -0.4305268322   2.9736992383
15
Conformer name: O35 Relative energy: 24.17 kcal/mol
C   0.3756180352  -0.2154911279  -0.3022475912
C  -0.1386410965  -0.1268496854   1.1109796533
N   1.3830014263   0.8203788007  -0.4525892021
H   1.0479456662   1.7782870989  -0.3659544275
H   2.2381702558   0.6716504661   0.0790729616
H   0.8520210669  -1.1997959347  -0.4226360593
C  -0.7522493525  -0.0754000488  -1.3322920432
H  -1.1570768804   0.9614890049  -1.3117587311
H  -1.5682499875  -0.7798109520  -1.0795962805
O  -0.1565646438  -0.3670247033  -2.5762876735
O   0.4650022275  -0.8119170214   2.0216846263
H  -0.8340446657  -0.3553054113  -3.2687632650
O  -1.0818505595   0.6732432848   1.5127703218
H  -1.5118622244   1.1357082460   0.7654795115
H   0.1312578182  -0.6074073826   2.9231024760
15
Conformer name: O36 Relative energy: 24.45 kcal/mol
C   0.5459604572   0.1539664790  -0.2666806605
C   0.0576413497  -0.0632283252   1.1382887202
N   0.5137507928   1.4991809785  -0.7528828391
H  -0.3947657218   1.7936642553  -1.1045568876
H   0.9127398819   2.1950577817  -0.1279218228
H   1.5803515827  -0.2414935244  -0.3037063384
C  -0.3829659300  -0.7765593044  -1.1514207372
H  -1.4337438259  -0.5915284762  -0.8759053461
H  -0.1404469385  -1.8338124465  -0.9371908278
O  -0.2861257011  -0.4527598729  -2.5097586211
O  -0.8093301444   0.7513411605   1.6306196298
H   0.5962878558  -0.6687870047  -2.8488417165
O   0.4097735260  -1.0655153362   1.8872416217
H   1.0876439056  -1.6258751796   1.4592861380
H  -1.0924299408   0.4859442733   2.5335437363
15
Conformer name: O37 Relative energy: 24.47 kcal/mol
C   0.5114613612   0.1477245139  -0.2657177527
C   0.0653056988  -0.0862646013   1.1414347971
N   0.3982904324   1.5421522080  -0.6169346845
H   1.2345189079   2.0710607494  -0.3720915906
H   0.2713791082   1.6155112808  -1.6280123438
H   1.5124164787  -0.3180221966  -0.3547882174
C  -0.4836881731  -0.6841204842  -1.1636339920
H  -1.5033961376  -0.3110465392  -0.9802315802
H  -0.4200728129  -1.7534900995  -0.9048835160
O  -0.1994732800  -0.4266146161  -2.5200741901
O  -0.7045215818   0.7815372071   1.7053474405
H   0.4894502059  -1.0320306762  -2.8329802562
O   0.4430181665  -1.2027403939   1.6892421108
H   0.0933610600  -1.3722085464   2.5874732719
H  -1.0043573800   0.5475035931   2.6080894181
15
Conformer name: O38 Relative energy: 24.88 kcal/mol
C   0.4073919993   0.1778505546  -0.2961141659
C   0.0647141696  -0.1239373632   1.1311423250
N   0.3971577795   1.6091407096  -0.5146150177
H   0.9360297321   1.8131413367  -1.3563568471
H  -0.5493319286   1.9520429024  -0.6901878761
H   1.4289451785  -0.2124791275  -0.4471429484
C  -0.5284657566  -0.6699023109  -1.2059077956
H  -1.5732364652  -0.3276362082  -1.0748142164
H  -0.4548673604  -1.7406031930  -0.9436396422
O  -0.0392781593  -0.4032414981  -2.5085101242
O   0.4158477855  -1.2842874967   1.5900807189
H  -0.5867480502  -0.8688048338  -3.1581851660
O  -0.5901709118   0.7625761065   1.8006503047
H  -0.8041265371   0.5217109088   2.7257248565
H   0.1464605647  -1.4760969280   2.5116082346
15
Conformer name: O39 Relative energy: 25.11 kcal/mol
C   0.3809600062  -0.3257961308  -0.2647605712
C  -0.1423383942  -0.1211814580   1.1288924338
N   1.2639660780   0.8474211960  -0.3373055996
H   2.2345452792   0.5991624225  -0.1488524710
H   1.2137967943   1.2473118384  -1.2771781139
H   0.9061945912  -1.2941556076  -0.3060100311
C  -0.7272145770  -0.2472045960  -1.3343754427
H  -1.3028931895   0.6796737051  -1.1960757514
H  -1.4098234462  -1.1077313459  -1.2422415589
O  -0.1228704140  -0.1560880974  -2.6141410418
O   0.5490732908  -0.6394633285   2.0936348140
H   0.0369435697  -1.0430437146  -2.9679523285
O  -1.1987718499   0.6055254147   1.2899668997
H  -1.4207016544   0.8275121290   2.2172070314
H   0.2629377843  -0.3963081324   2.9980968031
15
Conformer name: O40 Relative energy: 25.39 kcal/mol
C   0.3793980338  -0.2260610653  -0.2859678491
C  -0.1139345228  -0.1068885954   1.1382836931
N   1.3981556448   0.7835590912  -0.5560202392
H   1.0989005339   1.7414291472  -0.3691389931
H   2.2963261559   0.6124545011  -0.1055250064
H   0.8290987400  -1.2239693874  -0.4172807129
C  -0.7658997538  -0.0859499439  -1.3135026325
H  -1.1731876241   0.9495986696  -1.2770918166
H  -1.5807904197  -0.7903878760  -1.0839012981
O  -0.2944335489  -0.4108838968  -2.5951602391
O   0.3495370593  -0.7963172062   2.1281247381
H   0.4222433313   0.2021366121  -2.8270527528
O  -0.9990625585   0.7553773626   1.5194766204
H  -1.3770695956   1.2455722426   0.7620502171
H   1.0023980382  -1.4617235062   1.8344956684
15
Conformer name: O41 Relative energy: 25.46 kcal/mol
C   0.4437379065   0.1893044557  -0.2797771448
C   0.0740366764  -0.1094159263   1.1401518573
N   0.4403143692   1.5746157493  -0.6778186959
H  -0.4237425493   2.0645539108  -0.4485473227
H   1.2369653694   2.1050065656  -0.3307106817
H   1.4312723520  -0.2650449167  -0.4576037332
C  -0.5699965987  -0.5978318658  -1.1916692927
H  -1.5653401862  -0.1236464260  -1.0856901957
H  -0.6316373558  -1.6522065410  -0.8839297687
O  -0.0965451254  -0.5820738805  -2.5098224774
O  -0.6819203083   0.7348323384   1.7677418915
H  -0.0290958091   0.3436498812  -2.7967227185
O   0.4797632646  -1.2370404385   1.6338695034
H   0.1693058418  -1.4467305273   2.5389004787
H  -0.9427896298   0.4762020067   2.6756604955
15
Conformer name: O42 Relative energy: 25.81 kcal/mol
C   0.4570615989   0.1649223790  -0.2771226538
C   0.0685952248  -0.1111481636   1.1371359003
N   0.4611282790   1.5936614250  -0.5209313552
H   0.9624915990   1.7703016251  -1.3921085563
H  -0.4879900166   1.9452903645  -0.6670799176
H   1.4764348712  -0.2379681376  -0.3983487059
C  -0.5006700569  -0.6779037779  -1.1996771686
H  -1.5351304637  -0.3291267304  -1.0398949321
H  -0.4372681441  -1.7515254665  -0.9539739567
O  -0.1679567148  -0.4006096702  -2.5431904193
O  -0.6661451421   0.7589596851   1.7449329510
H   0.4231588068  -1.0883780153  -2.8823349341
O   0.4373186118  -1.2475709959   1.6430459864
H   0.1185212338  -1.4314739194   2.5503027940
H  -0.9276902237   0.5290799107   2.6604181522
15
Conformer name: O43 Relative energy: 26.7 kcal/mol
C   0.3809829140  -0.1989928492  -0.3056182138
C  -0.1325277848  -0.1228134523   1.1167498186
N   1.4039789264   0.8160282173  -0.4790954525
H   1.0860401708   1.7779549755  -0.3735225903
H   2.2714244123   0.6583737271   0.0293406794
H   0.8351450704  -1.1920827934  -0.4608134921
C  -0.7570746296  -0.0438819458  -1.3263675599
H  -1.1106323298   1.0103572703  -1.3346546734
H  -1.6018059950  -0.7004581925  -1.0412176968
O  -0.1877326692  -0.4089974759  -2.5633034718
O  -1.0259663511   0.7228116257   1.5190863432
H  -0.8539710939  -0.3320439875  -3.2625766122
O   0.3523322147  -0.8152449670   2.0951069152
H   1.0048658060  -1.4732690998   1.7850450630
H  -1.4075713278   1.2284200444   0.7746753682
15
Conformer name: O44 Relative energy: 27.67 kcal/mol
C   0.3730908685  -0.1913081923  -0.3003890879
C  -0.1440848549  -0.1368113225   1.1068837123
N   1.3612406840   0.8727213360  -0.3865241707
H   1.0010065770   1.8152017651  -0.2501993980
H   2.2295611219   0.7112505789   0.1183049559
H   0.8731032320  -1.1602621532  -0.4443649753
C  -0.7397789422  -0.0377524973  -1.3431363641
H  -1.0932662319   1.0094867201  -1.3574304660
H  -1.5893221442  -0.6943133247  -1.0747726886
O  -0.1352439526  -0.4228939026  -2.5627422517
O   0.4546391311  -0.8661855779   1.9972619172
H  -0.7481844066  -0.2517787289  -3.2922835442
O  -1.0974840185   0.7046849412   1.3732696091
H  -1.3283927336   0.7963349313   2.3200786293
H   0.1766549157  -0.7173927012   2.9244422328
15
Conformer name: O45 Relative energy: 28.83 kcal/mol
C   0.3944916286  -0.2486292857  -0.2736070820
C  -0.1392925685  -0.1258333869   1.1244642949
N   1.3470653865   0.8378789887  -0.4116215714
H   0.9499642093   1.7748752119  -0.4197172697
H   2.1954697980   0.7690435015   0.1443974337
H   0.9282529842  -1.2080199582  -0.3451939938
C  -0.7250224958  -0.1614267825  -1.3342492727
H  -1.2085131213   0.8260269227  -1.2677226016
H  -1.4885632635  -0.9323700410  -1.1271977289
O  -0.1805512283  -0.2609786018  -2.6316087572
O   0.4467284450  -0.8121330533   2.0579204400
H  -0.1049807296  -1.1920775408  -2.8850811881
O  -1.0982782285   0.7241324165   1.3379694931
H  -1.3363525623   0.8661535923   2.2766712608
H   0.1522531569  -0.6217626840   2.9724577435
15
Conformer name: O46 Relative energy: 29.17 kcal/mol
C   0.3850919240   0.6203604592  -0.2949852393
C   0.0253754539  -0.2067484635   0.8619391214
N  -0.3993879244   1.4166884850   0.7273564637
H   0.1082749217   2.1126253888   1.2745798493
H  -1.3670106387   1.6433508049   0.4918053066
H   1.4357233225   0.9233081290  -0.3338179486
C  -0.2783537106   0.4043755865  -1.6478334624
H  -0.2004429299   1.3372731739  -2.2267738947
H  -1.3440896084   0.1525262516  -1.5232310297
O   0.4510285865  -0.5997924885  -2.3329316244
O   0.9724733755  -0.4046472556   1.7901332994
H   0.0132714906  -1.4553026514  -2.2174137248
O  -1.0417572634  -1.0138322911   0.7372191377
H  -1.3425471181  -1.3673429700   1.5926102618
H   0.6129697883  -0.7439398151   2.6286952415
