%chk=000188485.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188485

0 1
S -3.663980 0.261704 -0.681420
O 0.686068 2.418401 0.671050
O -2.042568 -2.275266 -0.500519
C 2.172604 0.079036 0.822625
C 3.067722 -0.125734 -0.409531
C 0.719152 0.063542 0.444629
C 4.553623 -0.129699 -0.026729
C -0.009290 1.263638 0.370892
C -1.375278 1.267786 0.014464
C 0.072276 -1.156912 0.159069
C -1.993610 0.031984 -0.266861
C -1.276801 -1.172194 -0.195032
C -2.299825 2.382604 -0.119617
C 5.448084 -0.333867 -1.247430
C -3.547640 2.002231 -0.482747
C -1.393751 -3.569347 -0.452035
H 2.426540 1.046308 1.312000
H 2.376142 -0.701979 1.582256
H 2.868844 0.676976 -1.147238
H 2.803318 -1.072405 -0.917627
H 4.815352 0.824378 0.472323
H 4.750590 -0.924696 0.718542
H 0.646274 -2.077423 0.219510
H -1.988247 3.401756 0.059603
H 5.304597 0.460528 -1.989145
H 5.241114 -1.287494 -1.745842
H 6.507228 -0.332489 -0.966852
H -4.412899 2.622135 -0.649330
H 0.101037 3.211787 0.612449
H -0.584514 -3.616826 -1.186181
H -2.217343 -4.240484 -0.729878
H -1.040917 -3.780477 0.561402


%chk=000188485-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188485

0 1
S -3.750669 0.339379 -0.727284
O 0.877005 2.281070 0.513025
O -2.267402 -2.355768 -0.358060
C 2.175098 -0.215646 0.803258
C 3.109649 -0.012872 -0.422070
C 0.702175 -0.123647 0.444581
C 4.605897 -0.090376 -0.044876
C 0.080469 1.132905 0.292010
C -1.295459 1.224032 -0.072806
C -0.067382 -1.303862 0.230297
C -2.028568 0.019436 -0.277513
C -1.430555 -1.250680 -0.131149
C -2.119600 2.404216 -0.279594
C 5.540239 0.107992 -1.257760
C -3.421424 2.111714 -0.623435
C -1.674130 -3.685279 -0.210513
H 2.423734 0.555879 1.556438
H 2.385741 -1.203043 1.259258
H 2.892445 0.973301 -0.875936
H 2.878462 -0.777633 -1.191367
H 4.825412 0.679162 0.723256
H 4.815556 -1.071846 0.428920
H 0.431813 -2.269783 0.358623
H -1.768686 3.436773 -0.182938
H 5.372019 1.094745 -1.729073
H 5.359742 -0.665299 -2.028387
H 6.604746 0.050752 -0.963937
H -4.235705 2.803740 -0.832641
H 0.332997 3.103010 0.443894
H -0.842991 -3.835412 -0.927090
H -2.488203 -4.390614 -0.432446
H -1.308523 -3.848844 0.822116


