%chk=000232972.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232972

0 1
N 0.746230 0.282918 0.168051
N -0.046844 1.217127 -0.096523
C 3.075229 -0.429735 -0.049060
C 4.460106 -0.189477 0.153450
C -3.488614 -0.316639 0.340213
C -4.235404 0.583053 -0.465701
C 2.144975 0.611766 0.314155
C -2.075967 -0.144344 0.458892
C -1.451106 0.895857 -0.200290
C -3.556164 1.649472 -1.139136
C 2.661985 -1.681042 -0.606366
C 4.892314 1.054750 0.713606
C 5.404886 -1.202575 -0.208179
C -4.169584 -1.380528 1.014632
C 2.590953 1.807213 0.846816
C -2.202091 1.810834 -1.011039
C -5.649897 0.403337 -0.584119
C 3.980376 2.023207 1.051380
C 3.590021 -2.634725 -0.943231
C 4.979944 -2.392461 -0.743315
C -5.527310 -1.529115 0.882703
C -6.276875 -0.625730 0.073114
H -1.503746 -0.840970 1.074525
H -4.140813 2.332923 -1.754805
H 1.595217 -1.863593 -0.752897
H 5.959176 1.215601 0.865458
H 6.464378 -1.007313 -0.049981
H -3.587780 -2.065148 1.630700
H 1.885464 2.595504 1.116043
H -1.672416 2.622429 -1.512635
H -6.214955 1.097772 -1.204253
H 4.303092 2.972749 1.477648
H 3.279904 -3.588818 -1.366817
H 5.692597 -3.167390 -1.021823
H -6.053627 -2.335425 1.391559
H -7.353154 -0.769682 -0.011774


%chk=000232972-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000232972

0 1
N 0.742887 0.345285 0.005627
N -0.057645 1.382966 -0.013781
C 3.044999 -0.462842 0.046491
C 4.471864 -0.204633 0.062734
C -3.412764 -0.418074 -0.053532
C -4.289121 0.741304 -0.071947
C 2.136106 0.665819 0.021636
C -1.999811 -0.227884 -0.033613
C -1.453166 1.069434 -0.031787
C -3.703325 2.052247 -0.069537
C 2.587634 -1.820588 0.055714
C 4.941681 1.148120 0.053846
C 5.383117 -1.313276 0.087377
C -3.999732 -1.730731 -0.056062
C 2.640265 1.982987 0.013538
C -2.321457 2.214732 -0.050090
C -5.707295 0.540556 -0.092119
C 4.039527 2.220027 0.029656
C 3.500397 -2.878483 0.079903
C 4.909366 -2.625730 0.095856
C -5.385366 -1.893676 -0.075876
C -6.246844 -0.748630 -0.094099
H -1.323073 -1.088803 -0.019811
H -4.362861 2.927663 -0.083421
H 1.509624 -2.000090 0.043356
H 6.022397 1.333702 0.066217
H 6.460571 -1.110014 0.099451
H -3.337834 -2.604798 -0.042151
H 1.925524 2.811174 -0.005631
H -1.855994 3.205449 -0.048193
H -6.366703 1.416605 -0.106070
H 4.412880 3.249834 0.022892
H 3.138748 -3.912779 0.086840
H 5.611516 -3.466418 0.114734
H -5.822571 -2.898003 -0.077578
H -7.333041 -0.890651 -0.109570


