%chk=000230006.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230006

0 1
O 0.290143 2.328444 -0.259012
O 4.729692 0.919703 -1.485275
N -1.050139 1.067721 1.157783
N 1.139381 0.325447 0.529903
N 5.707721 -0.951663 -0.672336
N 3.252462 -2.538064 1.398611
C -3.982138 0.096014 0.441156
C -4.964061 -0.455927 -0.601385
C -3.216576 1.307519 -0.103425
C -5.733638 -1.669643 -0.061420
C -2.252108 1.915440 0.922228
C -6.711321 -2.221145 -1.096192
C 0.097097 1.329054 0.403076
C 2.360181 0.501541 -0.112095
C 3.394232 -0.391707 -0.015004
C 4.633975 -0.074690 -0.778833
C 3.322789 -1.573170 0.760921
H -3.276582 -0.700554 0.743501
H -4.532865 0.378825 1.359952
H -5.678138 0.333876 -0.905692
H -4.420350 -0.737803 -1.523944
H -2.668245 1.031950 -1.026983
H -3.935519 2.091319 -0.421654
H -5.023372 -2.464234 0.240374
H -6.283481 -1.389450 0.858573
H -2.749470 2.056563 1.909169
H -1.919102 2.926838 0.580289
H -7.456022 -1.472412 -1.389902
H -6.196571 -2.545352 -2.008041
H -7.256489 -3.087321 -0.703698
H -1.241650 0.131265 1.507850
H 1.006777 -0.487089 1.136232
H 2.466675 1.420807 -0.736459
H 6.556639 -0.751989 -1.180735
H 5.704273 -1.782013 -0.108529


%chk=000230006-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230006

0 1
O 0.282272 2.370404 -0.445792
O 4.818639 0.904232 -1.517099
N -1.029228 1.078802 1.006912
N 1.166085 0.397630 0.490509
N 5.711059 -1.032761 -0.588710
N 3.188113 -2.487737 1.557896
C -3.941458 0.065349 0.400712
C -5.029382 -0.441848 -0.572614
C -3.300538 1.395621 -0.055675
C -5.696230 -1.759114 -0.113902
C -2.222096 1.943633 0.906671
C -6.772138 -2.262868 -1.099724
C 0.121432 1.366517 0.298347
C 2.382108 0.513529 -0.138418
C 3.428862 -0.381339 0.002172
C 4.696581 -0.108023 -0.762782
C 3.301153 -1.525557 0.846470
H -3.159053 -0.717353 0.497720
H -4.385932 0.196534 1.410317
H -5.808528 0.339999 -0.690824
H -4.582101 -0.588111 -1.577666
H -2.853579 1.276254 -1.061791
H -4.091330 2.167331 -0.150257
H -4.916579 -2.538152 0.013146
H -6.150986 -1.608084 0.886586
H -2.645254 2.072229 1.921645
H -1.866488 2.926793 0.554809
H -7.577680 -1.514787 -1.224620
H -6.336297 -2.455366 -2.098150
H -7.235618 -3.202311 -0.746919
H -1.099190 0.222853 1.559343
H 1.013491 -0.401188 1.115656
H 2.506191 1.384309 -0.792179
H 6.585069 -0.882560 -1.090160
H 5.612829 -1.846762 0.017375


