31
Cycle # 0
C      -4.394497    0.698769    0.421354
C      -4.504613   -0.640849   -0.141092
C      -3.266831   -1.267916   -0.601745
C      -2.064301   -0.654971   -0.479838
C      -1.966148    0.666069    0.106967
C      -3.195469    1.321761    0.499266
O      -5.604026   -1.213715   -0.270977
N      -0.863607    1.365979    0.273247
C       0.394047    0.812820    0.140269
C       1.418955    1.646567   -0.341744
C       0.757396   -0.471466    0.587991
C       2.717900    1.193894   -0.471504
C       2.068121   -0.911914    0.507136
C       3.079906   -0.111825   -0.067434
N       4.367937   -0.572075   -0.209272
C       5.421862    0.397502   -0.451662
C       4.752115   -1.767634    0.518351
H       6.365079   -0.133224   -0.533034
H       5.255789    0.923150   -1.389081
H       5.504293    1.135755    0.351310
H       4.140103   -2.613567    0.214988
H       5.783262   -2.003292    0.275116
H       4.665889   -1.644881    1.602460
H       0.022604   -1.091753    1.084030
H       2.307262   -1.879075    0.920974
H       3.462774    1.870724   -0.861110
H       1.165469    2.658467   -0.627261
H      -3.100673    2.322526    0.898873
H      -5.305838    1.177165    0.752078
H      -3.356658   -2.230234   -1.086826
H      -1.173708   -1.112751   -0.887177