%chk=000275489.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275489

0 1
S -0.036645 0.460339 -1.720505
O 3.049817 2.850475 -0.789961
O -1.989923 0.490394 1.130941
O 1.748880 -1.361479 0.615726
O -3.126210 -1.933757 -2.642844
N 2.034179 0.868282 -0.060299
N -2.192360 -0.842066 -0.789457
C 5.782143 1.283195 -0.402355
C -5.143942 0.707240 0.999043
C 6.741587 0.241257 0.225145
C -6.587020 0.260209 0.656156
C 4.369393 0.842977 -0.188632
C -4.182527 0.000413 0.098200
C 6.302654 -1.211088 -0.020474
C -6.839661 0.137331 -0.854915
C 3.985995 -0.381967 0.225715
C -4.514962 -0.691357 -1.010919
C 4.901002 -1.500143 0.550688
C -5.892009 -0.877647 -1.522900
C 3.157724 1.713447 -0.421201
C -2.684868 -0.023126 0.293648
C 2.475494 -0.451388 0.312506
C -3.271157 -1.262533 -1.658279
C 6.043839 1.491182 -1.897153
C -4.958194 2.222714 0.875727
C 0.638085 1.259740 -0.218527
C -0.781401 -1.080644 -1.071521
H 5.934923 2.264042 0.122111
H -4.925216 0.410360 2.059433
H 6.808395 0.425513 1.315106
H 7.762707 0.392539 -0.172308
H -7.309345 0.972874 1.096437
H -6.785888 -0.714720 1.142378
H 7.037359 -1.905821 0.427673
H 6.305727 -1.418538 -1.109056
H -6.711460 1.129056 -1.332509
H -7.889665 -0.158795 -1.036836
H 4.508567 -2.461131 0.154923
H 4.948081 -1.633799 1.654214
H -6.227419 -1.918766 -1.319322
H -5.921658 -0.770440 -2.628305
H 5.911443 0.564637 -2.467430
H 5.356974 2.238223 -2.318953
H 7.063594 1.847961 -2.077649
H -5.158460 2.576753 -0.142017
H -5.629356 2.763026 1.552010
H -3.930615 2.516776 1.130719
H 0.036622 0.976922 0.682572
H 0.562559 2.363936 -0.364707
H -0.672826 -1.862735 -1.860740
H -0.240656 -1.423375 -0.152896


%chk=000275489-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000275489

0 1
S -0.048729 0.570389 -1.988512
O 3.223813 2.853107 -1.007777
O -2.060885 0.512371 1.094427
O 1.801626 -1.329605 0.588899
O -3.293707 -1.821489 -2.791411
N 2.140625 0.883719 -0.219141
N -2.302735 -0.753632 -0.905736
C 5.923664 1.268566 -0.415100
C -5.240120 0.650066 1.062806
C 6.835396 0.263817 0.352802
C -6.684397 0.148855 0.755853
C 4.488906 0.845354 -0.242656
C -4.286030 -0.002648 0.097117
C 6.415768 -1.214930 0.137206
C -6.997046 0.104943 -0.763851
C 4.070379 -0.366886 0.234615
C -4.644576 -0.676990 -1.038409
C 4.977464 -1.485951 0.654701
C -6.053815 -0.871450 -1.515673
C 3.278283 1.682451 -0.557428
C -2.784965 -0.015909 0.210280
C 2.566625 -0.389635 0.249858
C -3.400234 -1.170561 -1.723755
C 6.294509 1.392353 -1.921488
C -5.114887 2.200612 1.011306
C 0.761234 1.290621 -0.416178
C -0.905219 -0.962827 -1.237247
H 6.044286 2.278044 0.028533
H -4.961841 0.340400 2.090972
H 6.794061 0.490864 1.437042
H 7.884176 0.407718 0.031816
H -7.411864 0.804127 1.270734
H -6.812542 -0.869375 1.175107
H 7.128751 -1.885149 0.651355
H 6.466791 -1.460243 -0.941515
H -6.887076 1.119480 -1.193940
H -8.048632 -0.197244 -0.921084
H 4.589574 -2.453078 0.282108
H 4.971920 -1.569782 1.761202
H -6.362027 -1.922714 -1.339083
H -6.110526 -0.724912 -2.610938
H 6.240565 0.411650 -2.427909
H 5.610183 2.086646 -2.439143
H 7.323646 1.781026 -2.026055
H -5.415108 2.593339 0.023002
H -5.765745 2.657189 1.778829
H -4.075964 2.517211 1.207911
H 0.129131 0.988632 0.433288
H 0.743572 2.383204 -0.547626
H -0.851982 -1.743342 -2.011296
H -0.320001 -1.251904 -0.350416


