%chk=000208367.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208367

1 1
O 1.360032 2.193311 -0.177931
O 1.759358 0.568651 -1.675382
N -2.399802 -0.166701 -0.790756
C -2.741582 -0.127018 0.702973
C -2.262529 -1.631933 -1.232505
C -1.057265 0.532661 -1.040496
C -4.002087 -0.930698 1.030638
C -3.529189 -2.439975 -0.942631
C -3.908629 -2.376902 0.538870
C -3.478458 0.515718 -1.603217
C -1.026425 1.993942 -0.587823
C 0.278664 2.681033 -1.010761
C 3.041886 0.603868 0.458821
C 2.169453 -0.116618 1.523472
C 3.759364 1.809267 1.109744
C 2.059635 1.080912 -0.619083
C 4.043843 -0.349962 -0.192232
C 1.379259 -1.306902 0.967120
C 0.285147 -1.780886 1.931541
C 4.506766 2.684320 0.110257
C -0.331276 -3.097328 1.467904
H -1.861251 -0.538239 1.277081
H -2.866465 0.930595 1.026764
H -2.008690 -1.670268 -2.315436
H -1.397008 -2.093585 -0.674963
H -0.243600 -0.049567 -0.515950
H -0.798355 0.463657 -2.126613
H -4.156885 -0.917170 2.133358
H -4.905567 -0.439613 0.614308
H -4.375210 -2.102241 -1.575483
H -3.356857 -3.497685 -1.245554
H -3.175715 -2.944004 1.149519
H -4.878630 -2.894016 0.702292
H -3.606568 1.571878 -1.302894
H -3.239415 0.503857 -2.682648
H -4.459243 0.017482 -1.477780
H -1.877664 2.569269 -1.008025
H -1.112132 2.068997 0.518215
H 0.525800 2.529919 -2.078836
H 0.269379 3.762895 -0.769709
H 1.485278 0.619878 1.990640
H 2.830716 -0.463871 2.344558
H 4.467350 1.432937 1.876460
H 3.018790 2.432034 1.654576
H 4.659000 -0.856924 0.561533
H 4.735461 0.182561 -0.861865
H 3.554971 -1.122109 -0.800068
H 2.078650 -2.142942 0.753050
H 0.921655 -1.052053 -0.015256
H 0.707576 -1.907921 2.950731
H -0.507292 -1.005211 2.030624
H 5.252996 2.118111 -0.461736
H 5.046888 3.490675 0.625128
H 3.827823 3.162155 -0.606157
H 0.422533 -3.897689 1.421684
H -0.775996 -3.017858 0.464925
H -1.104986 -3.445894 2.163006


%chk=000208367-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208367

1 1
O 1.201116 1.987728 0.226930
O 1.668090 0.639811 -1.607013
N -2.680106 -0.022979 -1.045384
C -2.888014 -0.465994 0.422512
C -2.572118 -1.284946 -1.946015
C -1.329821 0.733858 -1.179609
C -4.072595 -1.429074 0.600543
C -3.747715 -2.259105 -1.777086
C -3.935034 -2.675280 -0.301183
C -3.825552 0.861150 -1.516390
C -1.228501 2.057719 -0.402902
C 0.167009 2.699287 -0.566455
C 3.125753 0.501758 0.419456
C 2.551199 -0.093264 1.753781
C 4.045960 1.719683 0.791502
C 1.966429 1.005697 -0.445064
C 3.914837 -0.566376 -0.375051
C 1.506009 -1.220913 1.598509
C 1.012391 -1.766982 2.958300
C 4.632657 2.502894 -0.401207
C -0.063269 -2.864700 2.813936
H -1.942683 -0.952755 0.724591
H -3.017563 0.450254 1.020806
H -2.478342 -0.920829 -2.983735
H -1.622834 -1.772553 -1.661071
H -0.551215 0.027940 -0.850741
H -1.179826 0.905528 -2.260198
H -4.091649 -1.723256 1.665956
H -5.032452 -0.912835 0.409275
H -4.683185 -1.830775 -2.183007
H -3.524093 -3.143071 -2.402121
H -3.066132 -3.278899 0.028866
H -4.825780 -3.318256 -0.199128
H -3.952605 1.697815 -0.814715
H -3.586430 1.246479 -2.519811
H -4.755151 0.279067 -1.557543
H -1.965950 2.795188 -0.772782
H -1.403789 1.914392 0.678547
H 0.477531 2.732831 -1.626525
H 0.157502 3.715397 -0.142747
H 2.109480 0.730649 2.346442
H 3.414203 -0.479063 2.332341
H 4.871443 1.318373 1.411668
H 3.466373 2.408968 1.433390
H 4.770458 -0.916073 0.229945
H 4.300806 -0.161389 -1.324584
H 3.287823 -1.437379 -0.628650
H 1.923718 -2.057025 1.003953
H 0.628721 -0.835748 1.029426
H 1.876651 -2.176152 3.517706
H 0.616931 -0.931790 3.571113
H 5.287980 1.876438 -1.030603
H 5.239408 3.350153 -0.035478
H 3.839014 2.921507 -1.048653
H 0.318778 -3.723614 2.231395
H -0.964556 -2.478379 2.293507
H -0.387806 -3.244311 3.799057


