%chk=000257253.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257253

0 1
S -0.674229 1.752431 0.001454
N 0.547525 -1.101976 0.001011
C 1.451623 -0.017716 0.000591
C -1.528327 0.222848 0.000597
C -0.861973 -0.988537 0.000435
C 2.873420 -0.302051 0.000297
C 1.017489 1.295827 0.000592
C -2.954410 0.282116 0.000271
C 3.778671 0.792219 -0.000185
C -3.684276 -0.939563 -0.000212
C -1.607195 -2.218246 -0.000138
C 1.933441 2.377112 0.000136
C -2.975820 -2.182648 -0.000424
C 3.284104 2.133896 -0.000288
C 3.401805 -1.630769 0.000539
C -3.683199 1.515396 0.000428
C 5.187647 0.532913 -0.000561
C -5.113560 -0.907948 -0.000462
C 4.756653 -1.852315 0.000227
C -5.056356 1.513624 0.000170
C 5.663152 -0.753707 -0.000369
C -5.784297 0.289177 -0.000266
H 0.941987 -2.043315 -0.000109
H -1.075895 -3.167276 -0.000308
H 1.552681 3.401431 0.000129
H -3.551598 -3.109733 -0.000846
H 3.997495 2.955460 -0.000699
H 2.714457 -2.477231 0.001038
H -3.144879 2.464724 0.000742
H 5.870919 1.381567 -0.001006
H -5.656593 -1.852234 -0.000816
H 5.157616 -2.864334 0.000448
H -5.611715 2.451372 0.000286
H 6.733658 -0.955819 -0.000665
H -6.871917 0.323704 -0.000434


%chk=000257253-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257253

0 1
S -0.700265 1.898461 0.002219
N 0.542319 -1.033231 0.001302
C 1.473248 0.021763 0.000882
C -1.570112 0.269995 0.000951
C -0.865371 -0.944738 0.000812
C 2.889829 -0.286535 0.000354
C 1.063078 1.366077 0.000937
C -3.004425 0.287573 0.000375
C 3.850132 0.801099 -0.000252
C -3.729048 -0.971678 -0.000270
C -1.596892 -2.179284 0.000139
C 2.016386 2.422788 0.000291
C -2.987633 -2.195172 -0.000359
C 3.385057 2.153171 -0.000301
C 3.395603 -1.631466 0.000449
C -3.765014 1.507394 0.000470
C 5.251866 0.500100 -0.000813
C -5.160862 -0.959981 -0.000787
C 4.768312 -1.892907 -0.000099
C -5.161480 1.484510 -0.000052
C 5.710216 -0.817685 -0.000764
C -5.871285 0.242358 -0.000678
H 0.917367 -1.979178 0.000919
H -1.033807 -3.121386 0.000049
H 1.657746 3.458063 0.000276
H -3.527795 -3.148301 -0.000836
H 4.111115 2.972923 -0.000789
H 2.719783 -2.495124 0.001073
H -3.242439 2.470173 0.000918
H 5.963210 1.334662 -0.001281
H -5.692845 -1.919074 -0.001275
H 5.126050 -2.928275 0.000007
H -5.721242 2.426354 0.000014
H 6.783813 -1.033711 -0.001202
H -6.966508 0.240659 -0.001075


