%chk=000200746.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200746

0 1
S 3.628884 1.240914 -0.522870
S -3.198480 1.878483 -1.072767
P -3.152204 0.086434 -0.385300
O -1.945515 -0.203514 0.768593
C -0.653470 0.168863 0.402098
C 1.551839 -0.546275 -0.275918
C 0.207940 -0.854813 -0.011652
C -4.608603 -0.453901 0.632124
C -2.874204 -1.239617 -1.661324
C 1.980215 0.784052 -0.121350
C -0.233163 1.494489 0.564203
C 1.103516 1.791917 0.290153
C 2.488497 -1.621388 -0.710291
C 4.487963 1.062527 1.061438
H -0.161313 -1.872151 -0.102072
H -4.371755 -1.344246 1.231482
H -5.480635 -0.676527 0.003379
H -4.909465 0.339443 1.336461
H -1.938220 -1.061859 -2.215281
H -3.681643 -1.248423 -2.407174
H -2.810823 -2.237043 -1.211049
H -0.928956 2.269713 0.885480
H 1.457188 2.820802 0.397394
H 2.986056 -1.362320 -1.659891
H 3.290897 -1.776262 0.027196
H 1.992836 -2.588835 -0.857896
H 4.445767 0.035548 1.435993
H 4.072386 1.730443 1.823218
H 5.539264 1.332946 0.899922


%chk=000200746-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200746

0 1
S 3.745614 1.396134 -0.590712
S -3.702903 2.092929 -0.906934
P -3.375542 0.109690 -0.385121
O -1.962531 -0.283836 0.657142
C -0.647709 0.136126 0.333248
C 1.671824 -0.541575 -0.152122
C 0.316543 -0.869892 0.103242
C -4.637351 -0.648360 0.749482
C -3.103460 -1.026039 -1.843765
C 2.029490 0.839018 -0.183319
C -0.292678 1.503788 0.300394
C 1.052017 1.839339 0.036988
C 2.682069 -1.649383 -0.383485
C 4.643604 0.973101 1.021241
H 0.001574 -1.919026 0.133620
H -4.322538 -1.667559 1.023340
H -5.617031 -0.663333 0.246840
H -4.699332 -0.023514 1.653133
H -2.198765 -0.691894 -2.375984
H -3.967007 -0.956253 -2.524084
H -2.969611 -2.060971 -1.489893
H -1.047426 2.274794 0.475578
H 1.354484 2.890739 0.004746
H 3.470679 -1.321759 -1.083148
H 3.180890 -1.939940 0.561994
H 2.196046 -2.554491 -0.786757
H 4.650760 -0.115029 1.186007
H 4.157418 1.488090 1.863184
H 5.675670 1.338505 0.899441


