404
Gaussian coordinates
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 C  10.378889  -4.242293  -3.674185
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 H  12.215587  -4.616745  -4.735461
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 H   5.679226  -3.738244  -5.997647
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 H   7.848160  -8.183727   0.572941
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 H   5.780320  -8.716671   0.367486
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 C   3.182834  -6.083345   7.151790
 C   3.510735  -5.713251   5.705903
 O   3.236424  -6.465542   4.769638
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 C -11.256652  -1.560481  -1.996324
 C -10.977224  -2.825704  -1.184734
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 C  -8.671680  -2.837700   2.224662
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 H -10.000427  -2.376020   3.842896
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 H -13.392158  -7.417530   0.095919
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 C  -6.309666   1.156316   9.331424
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 H  -6.605612   0.859275  10.336378
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 C  -2.569831   1.413171   8.585839
 C  -1.833355   2.234410   9.643758
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 O   0.190460   2.136368   7.242828
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 H  -2.290779   0.365763   8.703129
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 N  -0.691889   1.726671  10.109037
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 H   1.102254   1.787250  11.172696
 H  -0.222666   2.755811  11.862929
 H   0.624437   3.318543  10.402077
 C   6.702558   8.511818   4.068536
 C   6.090030   7.564112   3.046396
 O   6.746268   7.059964   2.132685
 H   5.935728   8.829201   4.775554
 H   7.109061   9.383632   3.557501
 H   7.501239   7.999974   4.605120
 N   4.792584   7.326924   3.226268
 C   3.958231   6.529011   2.331509
 C   2.890514   7.456534   1.764796
 O   2.045117   7.951565   2.503282
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 C   2.473560   4.438960   2.208638
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 H   4.532332   6.107052   1.506812
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 H   2.770814   5.703426   3.926061
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 H   8.808644   8.194191  -0.002911
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 H   9.719001   6.934905  -0.870716
Fe  -6.241435  -1.610997   1.088792
 C   8.994400  -4.926356  -1.781059
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 C   6.771206  -3.816079  -4.117698
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 C   4.391737  -4.189165  -4.324884
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 C   6.101772  -3.590265   4.496213
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 C   1.994412  -4.286437   2.541038
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 C  -7.086063  -2.392286  -1.775401
 C  -5.309703  -1.147826  -1.776486
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 C  -0.781737   1.563000   6.707787
 N  -0.655999   0.699352   5.657253
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 H   0.259556   0.501621   5.289031
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 C   2.551156   2.497414   3.913121
 N   3.464242   1.581383   3.139367
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 H   1.922495   1.878230   4.555017
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 H   4.126389   2.115216   2.510622
 H   4.069543   0.976148   3.724511
 C  -1.740972   4.809318   3.329529
 C  -3.578656   4.457356   1.810551
 C  -1.974236   3.595216   3.980173
 C  -3.834462   3.248395   2.446887
 C  -3.043735   2.826507   3.537706
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 H  -4.662961   2.630187   2.115627
 H  -3.282974   1.893368   4.040410
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 H  -5.179999   1.666388  -0.311373
 C   5.829322   2.361832   0.502582
 O   5.249323   2.785637   1.543026
 N   5.505797   1.200988  -0.090951
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 O  -5.286816  -5.247009  -1.443454
 H  -5.513922  -4.388402  -1.806501
 H  -5.572032  -5.868558  -2.115505
 O  -3.358281  -3.136117  -4.279824
 H  -4.159131  -3.652658  -4.396775
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 H  -5.388661  -4.135326   0.566323
 H   5.848313  -0.932415   4.676167
 H   6.395017   0.553425   4.513830
 H  -2.110412  -3.067914  -0.911167
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 H  -1.686415  -3.694719  -5.175015
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 H  -2.787666  -1.526875   3.878610
 H  -3.155616  -3.108496  -3.311049
 C  -1.255335   0.355781   1.981932
 N   0.401532  -0.589155   1.031734
 C   1.687778  -0.794682   0.577834
 C   0.897253  -3.820904  -1.555323
 C   4.159661  -2.568380   0.100004
 C   3.149395  -2.040971  -0.913011
 N   1.790059  -1.842018  -0.328581
 C   0.692983  -2.626100  -0.683415
 C  -0.697062  -1.293255   0.579150
 C  -1.795629  -0.693889   1.180790
 C  -3.197906  -0.996618   1.055259
 N  -0.523787  -2.350790  -0.265245
 N  -4.309388  -1.160918   1.015713
 N   0.069652   0.421502   1.908658
 O   2.648934  -0.088232   0.925746
 H  -1.800549   1.065965   2.581509
 H  -0.060855  -4.326970  -1.667136
 H   1.612656  -4.510529  -1.093898
 H   1.265291  -3.568963  -2.556578
 H   5.138505  -2.642193  -0.378493
 H   3.888799  -3.562625   0.465526
 H   4.246683  -1.892920   0.951201
 H   3.062047  -2.714607  -1.762375
 H   3.461543  -1.069902  -1.307452
