88
BARTOF
C       2.645121    1.097982   17.884630
H       2.255152    1.972431   17.632820
H       2.383890    0.908694   18.819605
C       4.141669    1.187234   17.803001
C       4.995878    0.172706   18.330845
C       4.672756   -0.961004   19.079558
H       3.765238   -1.162157   19.277627
C       5.691445   -1.791636   19.532084
H       5.479062   -2.561599   20.045068
C       7.022460   -1.502580   19.237932
H       7.716788   -2.082984   19.528012
C       7.319777   -0.348512   18.512222
C       8.593802    0.215174   18.183057
C       2.065660    0.011055   16.973065
H       2.357364    0.168526   16.051118
H       1.086922    0.037750   17.016017
H       2.381702   -0.866899   17.270474
C       9.884719   -0.468503   18.541942
H       9.840173   -0.759042   19.487299
H      10.624706    0.184705   18.463366
C      10.201927   -1.682431   17.667426
H       9.457089   -2.317573   17.708139
H      11.019198   -2.115341   17.993130
H      10.333467   -1.391353   16.741204
C       4.125232    3.352594   16.735912
C       3.843053    3.445890   15.364289
C       3.302607    4.636629   14.876750
H       3.116369    4.718735   13.948289
C       3.033666    5.699827   15.720732
H       2.675841    6.507810   15.373246
C       3.290300    5.578084   17.078105
H       3.088572    6.304230   17.655212
C       3.837399    4.412691   17.613278
C       4.157430    2.319191   14.400204
H       4.498082    1.541004   14.929474
C       2.921979    1.861878   13.615053
H       2.214347    1.601673   14.241423
H       3.157359    1.094747   13.052602
H       2.603559    2.596652   13.050567
C       5.258402    2.755202   13.424516
H       4.919500    3.472989   12.849037
H       5.526236    1.991306   12.871429
H       6.033239    3.080660   13.929969
C       4.116487    4.320609   19.105614
H       4.548666    3.436587   19.281698
C       2.820721    4.378312   19.922929
H       2.373058    5.235099   19.766184
H       3.031195    4.290004   20.875614
H       2.229881    3.645560   19.650151
C       5.082028    5.412794   19.572389
H       5.899540    5.378010   19.033349
H       5.306556    5.268805   20.515304
H       4.658064    6.290748   19.466943
C       9.690322    2.123026   17.224672
C      10.256309    1.941962   15.949132
C      11.371429    2.705318   15.622003
H      11.767165    2.604742   14.764586
C      11.917227    3.608349   16.516061
H      12.681798    4.116085   16.273004
C      11.348765    3.769056   17.760659
H      11.731328    4.388424   18.371762
C      10.222883    3.041427   18.141733
C       9.641149    0.975025   14.952477
H       9.292945    0.192794   15.468922
C      10.634409    0.442617   13.931801
H      10.927487    1.174291   13.347772
H      10.206508   -0.254812   13.392556
H      11.410371    0.064714   14.396133
C       8.449591    1.633761   14.259948
H       7.773251    1.869967   14.927438
H       8.063289    1.009809   13.610371
H       8.747627    2.444305   13.797651
C       9.618554    3.253366   19.519870
H       8.781094    2.709902   19.572797
C      10.563482    2.766931   20.621972
H      10.763886    1.817387   20.484769
H      10.135515    2.887866   21.496488
H      11.395039    3.284240   20.590623
C       9.243246    4.719409   19.754173
H      10.057578    5.260715   19.804861
H       8.746490    4.798279   20.594694
H       8.685443    5.036913   19.012992
N       4.823227    2.193807   17.234443
N       6.310709    0.470795   18.071707
N       8.491044    1.401464   17.565236
N       7.110534    3.756652   16.778864
N       7.321315    4.824569   16.550667
Fe      6.726956    2.025187   17.174798
