%chk=000246897.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246897

0 1
S 3.406941 1.549850 -0.807594
S -3.407153 1.549303 0.807759
O 0.836179 -2.407585 0.798749
O -0.835846 -2.407495 -0.799109
O 2.132585 0.737757 -0.041101
O -2.132537 0.737561 0.041328
O 2.922440 1.944551 -2.101226
O 4.556822 0.693032 -0.704628
O -2.922887 1.943985 2.101484
O -4.556833 0.692240 0.704576
C 0.662328 -1.033899 0.397780
C -0.662108 -1.033874 -0.397867
C 0.000206 -3.288213 -0.000273
C 1.893182 -0.626443 -0.427676
C -1.892997 -0.626682 0.427667
C 0.862534 -4.091599 -0.952506
C -0.862041 -4.091874 0.951800
C 3.498391 2.896897 0.277952
C -3.498779 2.896441 -0.277660
H 0.624989 -0.454053 1.347699
H -0.624815 -0.453836 -1.347671
H 1.726395 -0.679379 -1.518172
H 2.771645 -1.244686 -0.145116
H -1.726196 -0.679775 1.518154
H -2.771398 -1.244972 0.145014
H 1.693523 -4.571210 -0.419187
H 0.283116 -4.871601 -1.461290
H 1.295932 -3.451936 -1.732668
H -0.282456 -4.871695 1.460675
H -1.295775 -3.452355 1.731892
H -1.692790 -4.571742 0.418340
H 3.366643 3.871154 -0.219426
H 2.722814 2.865235 1.065664
H 4.456242 2.956801 0.820469
H -2.723276 2.864891 -1.065448
H -4.456685 2.956343 -0.820079
H -3.367035 3.870661 0.219793


%chk=000246897-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246897

0 1
S 3.466160 1.538549 -1.122463
S -3.464990 1.530841 1.138242
O 0.775091 -2.444974 0.890267
O -0.775597 -2.436766 -0.906968
O 1.795035 0.725090 -0.763329
O -1.793880 0.720413 0.771802
O 3.683549 1.710460 -2.713894
O 4.584882 0.791990 -0.215691
O -3.681758 1.689812 2.731126
O -4.584068 0.791524 0.226009
C 0.669632 -1.061101 0.381943
C -0.669185 -1.057119 -0.387144
C -0.000645 -3.347840 -0.012188
C 1.891056 -0.725229 -0.500136
C -1.890101 -0.727916 0.498086
C 0.931144 -4.186130 -0.892725
C -0.933412 -4.192271 0.861340
C 2.982423 3.203727 -0.355983
C -2.981553 3.202069 0.384938
H 0.649200 -0.389521 1.256368
H -0.648360 -0.377992 -1.255705
H 1.867755 -1.281693 -1.454759
H 2.819436 -0.957970 0.056400
H -1.866506 -1.291374 1.448714
H -2.818741 -0.956559 -0.059777
H 1.538145 -4.860813 -0.265377
H 0.336417 -4.793617 -1.596510
H 1.606470 -3.538921 -1.474969
H -0.339340 -4.806206 1.560085
H -1.608354 -3.549147 1.449021
H -1.541091 -4.860958 0.228270
H 3.835866 3.875137 -0.523412
H 2.079127 3.526862 -0.889538
H 2.796108 3.004797 0.706673
H -2.078114 3.520998 0.920772
H -2.795531 3.011543 -0.679304
H -3.834973 3.872101 0.557913


