%chk=000265494.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265494

0 1
S -1.699843 2.374370 0.274790
O -2.807006 2.918101 1.332824
O -1.316727 3.155278 -1.094329
N -0.015864 2.291956 1.331198
N 0.864475 -3.647420 0.149394
C 1.005977 1.521586 0.706839
C 1.356998 0.201825 1.147527
C 2.378983 -0.479825 0.431712
C 2.677710 1.442047 -1.102375
C 1.668595 2.126976 -0.395729
C 3.018092 0.134110 -0.672081
C -2.099243 0.581021 -0.157001
C 0.632893 -0.412041 2.334981
C 2.783953 -1.917442 0.789180
C 3.377781 2.078080 -2.289685
C -2.946124 -0.134985 0.705304
C -1.476822 0.010446 -1.280753
C -2.501171 -2.147631 -0.655235
C -3.147368 -1.507711 0.436594
C -1.686588 -1.364550 -1.517730
C -2.632548 -3.640048 -0.878826
C 1.731009 -2.896391 0.443262
H -0.358215 1.907101 2.231230
H 1.373153 3.142171 -0.677235
H 3.798731 -0.418157 -1.211107
H 1.040928 -1.393929 2.618346
H 0.700136 0.233558 3.232129
H -0.439831 -0.568356 2.112906
H 3.018469 -2.023225 1.865495
H 3.701779 -2.194583 0.239480
H 3.074137 1.594513 -3.237854
H 3.134384 3.150347 -2.371852
H 4.476131 1.981441 -2.211460
H -3.439707 0.368428 1.543536
H -0.853121 0.620538 -1.941442
H -3.804382 -2.091171 1.091366
H -1.194602 -1.842050 -2.372446
H -1.676526 -4.134935 -0.620727
H -3.428725 -4.080861 -0.255441
H -2.853001 -3.875284 -1.935780


%chk=000265494-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265494

0 1
S -1.682496 2.388551 0.316349
O -2.778171 2.913386 1.395995
O -1.320992 3.190662 -1.046302
N 0.011938 2.297762 1.349361
N 0.780500 -3.651472 0.141435
C 1.017524 1.516358 0.712355
C 1.358219 0.192064 1.150587
C 2.355128 -0.505473 0.418166
C 2.654719 1.408137 -1.126317
C 1.665975 2.108720 -0.403073
C 2.980879 0.096257 -0.702323
C -2.078079 0.598780 -0.133394
C 0.641183 -0.410446 2.347951
C 2.741585 -1.949907 0.767951
C 3.362413 2.053444 -2.303937
C -2.919034 -0.128618 0.725292
C -1.461989 0.042618 -1.267728
C -2.480219 -2.123974 -0.662546
C -3.120365 -1.498094 0.441157
C -1.672214 -1.329470 -1.520396
C -2.609350 -3.614174 -0.901037
C 1.669338 -2.910799 0.430210
H -0.320703 1.922778 2.257069
H 1.375045 3.125451 -0.685445
H 3.738306 -0.470778 -1.258157
H 1.039212 -1.397731 2.626842
H 0.728643 0.234957 3.243456
H -0.436436 -0.551895 2.139518
H 2.984810 -2.061823 1.841631
H 3.649758 -2.239878 0.209050
H 3.845052 1.301004 -2.951405
H 2.659736 2.639798 -2.921642
H 4.150919 2.749709 -1.959153
H -3.407951 0.364205 1.572492
H -0.843242 0.660638 -1.925610
H -3.772845 -2.090218 1.092711
H -1.185674 -1.795442 -2.384528
H -1.666862 -4.114274 -0.604873
H -3.433292 -4.055127 -0.314904
H -2.784070 -3.842390 -1.967806


