%chk=000208432.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208432

0 1
O -0.100564 2.500745 0.046501
O 4.177088 0.816903 0.065424
O -5.386172 -0.447993 -0.283736
N 0.156809 0.200046 0.008190
N 2.064241 1.676070 0.043908
N 3.195517 -1.951107 0.036168
C 0.999882 -0.935425 0.009764
C 2.360148 -0.758994 0.030582
C 0.656249 1.551799 0.031689
C 2.987183 0.567654 0.046908
C -1.290831 0.036836 -0.025662
C 0.333187 -2.266122 -0.009973
C 2.605451 3.063104 0.041450
C -2.011695 0.027731 1.175122
C -1.939587 -0.090606 -1.270912
C 4.057198 -1.995440 -1.185911
C 4.027952 -2.004952 1.277995
C -3.399370 -0.134867 1.147694
C -3.316320 -0.253638 -1.308632
C -4.036966 -0.273647 -0.092207
C -6.246430 -0.432444 0.882285
H -0.260814 -2.417337 -0.923933
H -0.339788 -2.406967 0.848936
H 1.078977 -3.085961 0.026286
H 3.663264 3.050020 0.366397
H 2.024712 3.707041 0.724472
H 2.555109 3.493887 -0.972505
H -1.496629 0.154818 2.128417
H -1.362383 -0.052863 -2.195895
H 4.597919 -2.953789 -1.199085
H 4.794429 -1.176539 -1.248985
H 3.419058 -1.955334 -2.081439
H 4.764470 -1.187496 1.364173
H 4.567144 -2.964066 1.297086
H 3.368895 -1.970247 2.158425
H -3.958981 -0.138889 2.077864
H -3.855170 -0.353485 -2.249666
H -6.002668 -1.266852 1.545558
H -7.237574 -0.567004 0.428122
H -6.178542 0.532812 1.392625


%chk=000208432-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208432

0 1
O -0.136766 2.548502 0.013703
O 4.234573 0.853501 0.073856
O -5.458904 -0.437439 -0.309966
N 0.169308 0.215966 -0.005300
N 2.044224 1.701484 0.047678
N 3.273799 -1.880542 0.052309
C 1.023565 -0.905089 0.008847
C 2.402229 -0.734014 0.039117
C 0.645076 1.558922 0.018930
C 2.986328 0.617357 0.054371
C -1.278613 0.050832 -0.051844
C 0.389116 -2.272178 -0.005911
C 2.557107 3.089948 0.066238
C -2.026504 0.044553 1.141184
C -1.931052 -0.091280 -1.298856
C 4.079002 -2.056417 -1.182311
C 4.067676 -2.040302 1.296433
C -3.428791 -0.117305 1.104771
C -3.325445 -0.255109 -1.349099
C -4.078747 -0.269947 -0.146505
C -6.293160 -0.426822 0.895772
H -0.211882 -2.429929 -0.919593
H -0.292301 -2.408884 0.853110
H 1.201255 -3.013359 0.036332
H 3.654919 3.029228 0.083553
H 2.182094 3.619796 0.957292
H 2.211000 3.632821 -0.828627
H -1.515433 0.179822 2.100201
H -1.346469 -0.059636 -2.224295
H 4.556631 -3.053697 -1.157848
H 4.870935 -1.284575 -1.294935
H 3.415819 -2.015945 -2.064233
H 4.861384 -1.270065 1.404698
H 4.540708 -3.040096 1.290754
H 3.396749 -1.984153 2.171604
H -3.993978 -0.114043 2.041001
H -3.853815 -0.362872 -2.300729
H -6.028112 -1.260094 1.575149
H -7.322547 -0.558053 0.532373
H -6.206579 0.536516 1.434276


