%chk=000259371.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259371

0 1
S -0.968052 0.221022 -1.556976
O -0.777148 -0.978896 -2.334556
O -1.234953 1.482401 -2.209877
N 0.471638 0.422407 -0.612824
C 1.503790 -0.543194 -0.426114
C 0.859266 1.600313 0.123518
C 2.492497 0.025561 0.439580
C 2.059962 1.375490 0.765073
C 1.629370 -1.842069 -0.939280
C -2.167797 -0.051856 -0.345117
C 0.005535 2.805454 0.117424
C 3.612412 -0.734759 0.799150
C 2.813992 2.304902 1.633002
C 2.752382 -2.569497 -0.562941
C 3.730922 -2.026765 0.298164
C -3.130805 0.930107 -0.087914
C -2.186007 -1.256513 0.365267
C -4.109063 0.711023 0.885372
C -3.164052 -1.477049 1.339954
C -4.123762 -0.492817 1.599543
H 0.887147 -2.252001 -1.628441
H -0.872270 2.693669 0.769490
H 0.561684 3.687389 0.471336
H -0.359457 3.057001 -0.898759
H 4.369055 -0.312527 1.455575
H 2.312013 3.274089 1.749194
H 2.951076 1.881854 2.639279
H 3.815746 2.500899 1.220847
H 2.887745 -3.581060 -0.944100
H 4.593012 -2.634345 0.564671
H -3.123165 1.869114 -0.654373
H -1.440628 -2.032381 0.160951
H -4.860272 1.474022 1.085155
H -3.177988 -2.414782 1.894458
H -4.887324 -0.664706 2.359871


%chk=000259371-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259371

0 1
S -0.904343 -0.025112 -1.326659
O -0.772910 -1.470550 -2.062187
O -0.959861 1.350559 -2.204139
N 0.508716 0.020057 0.115831
C 1.701880 -0.729682 -0.143552
C 0.898888 1.319139 0.575975
C 2.811877 0.060882 0.303073
C 2.282921 1.350556 0.753671
C 1.865719 -2.036498 -0.638602
C -2.453163 -0.061484 -0.242398
C -0.130326 2.370504 0.875640
C 4.112669 -0.487379 0.288219
C 3.110475 2.448794 1.360592
C 3.183500 -2.555773 -0.680185
C 4.290266 -1.797388 -0.218458
C -3.324467 1.035211 -0.323360
C -2.689893 -1.199562 0.544898
C -4.511258 0.984829 0.444672
C -3.878902 -1.227057 1.309898
C -4.783719 -0.139459 1.258705
H 1.015984 -2.619155 -1.000310
H -0.941284 1.972911 1.512804
H 0.331113 3.220101 1.404385
H -0.588176 2.761450 -0.053147
H 4.967366 0.083114 0.669022
H 2.502750 3.326794 1.635094
H 3.638298 2.103182 2.270485
H 3.886789 2.789885 0.648204
H 3.346850 -3.564782 -1.073993
H 5.293820 -2.236070 -0.250183
H -3.084620 1.884055 -0.972144
H -1.981812 -2.033486 0.560550
H -5.217998 1.819931 0.402577
H -4.096396 -2.096136 1.939193
H -5.704253 -0.170882 1.851431


