%chk=000192259.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192259

0 1
S -2.710097 1.737745 -1.112124
O -2.306079 -2.411979 0.459194
O 1.398143 0.429727 0.871453
O -5.636074 -2.383642 -0.776151
O -5.933567 -1.900361 1.392763
O 5.049712 1.596098 -0.287200
O 3.444596 2.827878 -1.362924
N -3.433172 -0.283578 0.562062
N -0.370023 0.002725 -0.510326
N 3.282516 0.449621 -1.233805
C -2.554445 0.918342 0.497469
C -1.317086 -0.029275 0.587602
C -2.338459 -1.226501 0.500236
C -4.708580 -0.347889 -0.053814
C -4.519857 1.875169 -1.203884
C -5.234300 0.614972 -0.848035
C 0.991442 0.251878 -0.255735
C -6.625733 0.489267 -1.376827
C -5.470462 -1.579326 0.329296
C 1.859300 0.253730 -1.521231
C 4.087607 -0.502908 -0.533445
C 5.189608 0.228118 0.003525
C 3.823243 1.757854 -0.987433
C 4.009761 -1.877257 -0.362987
C 6.221247 -0.366459 0.703590
C 5.056894 -2.492413 0.346499
C 6.131096 -1.760945 0.864326
H -2.702360 1.618438 1.343243
H -0.788208 0.023862 1.576530
H -0.742536 -0.098306 -1.453365
H -4.742458 2.183884 -2.251009
H -4.867983 2.708940 -0.554207
H -7.372804 0.621139 -0.577899
H -6.799599 -0.506719 -1.822124
H -6.861734 1.224040 -2.157234
H 1.525419 1.074603 -2.210276
H 1.738940 -0.707622 -2.079010
H -6.090777 -3.243314 -0.556097
H 3.180350 -2.459825 -0.752825
H 7.049898 0.210758 1.106497
H 5.023412 -3.571937 0.498416
H 6.920510 -2.279131 1.409870


%chk=000192259-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192259

0 1
S -2.813176 1.734459 -1.489646
O -2.132180 -2.465085 -0.062041
O 1.365803 0.711389 0.950809
O -6.458526 -2.248612 -0.376510
O -4.985041 -2.365925 1.413630
O 5.488085 1.473120 -0.507142
O 3.894104 2.859267 -1.596367
N -3.400687 -0.387127 0.190842
N -0.238713 0.124953 -0.637476
N 3.430400 0.597942 -0.973400
C -2.613515 0.858793 0.180816
C -1.308987 -0.015808 0.320995
C -2.266207 -1.249250 0.133715
C -4.766252 -0.524825 -0.162461
C -4.708848 1.735470 -1.353612
C -5.407895 0.470240 -0.867775
C 1.050814 0.471580 -0.244366
C -6.886887 0.480632 -1.199208
C -5.382745 -1.772062 0.387184
C 2.052364 0.543190 -1.421644
C 4.163221 -0.418848 -0.322366
C 5.438758 0.131193 -0.046456
C 4.201961 1.770146 -1.088187
C 3.851950 -1.739830 0.037469
C 6.452711 -0.587649 0.587791
C 4.871365 -2.486826 0.680801
C 6.144849 -1.925466 0.950531
H -2.849152 1.562795 0.992119
H -0.867598 0.054458 1.329754
H -0.442571 -0.056926 -1.623295
H -5.057739 1.971155 -2.375178
H -4.992665 2.588079 -0.707996
H -7.471246 -0.205137 -0.571544
H -7.043372 0.171771 -2.251333
H -7.293123 1.505042 -1.096112
H 1.863333 1.470618 -1.995508
H 1.903301 -0.317971 -2.101900
H -6.793443 -3.084991 0.048447
H 2.865785 -2.175775 -0.148169
H 7.427869 -0.138923 0.793115
H 4.664841 -3.518966 0.982026
H 6.906356 -2.530891 1.452253


