%chk=000107089.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000107089

0 1
S 2.131903 -0.383157 -0.382601
O 1.085708 0.962191 1.565844
O -0.688430 1.707477 0.146981
O 3.368568 0.452781 0.434873
O 2.581912 -1.734038 -0.547432
O 1.840652 0.440570 -1.518156
C 0.988561 -0.347112 1.009496
C -0.407173 -0.584058 0.535447
C -1.251813 0.464088 0.087888
C -0.919751 -1.891321 0.542634
C -2.558859 0.198686 -0.362717
C -2.213255 -2.158923 0.097235
C -3.028041 -1.111890 -0.354094
C -1.399392 2.810041 -0.474134
H 1.284259 -1.101230 1.783147
H -0.292305 -2.714860 0.891621
H -3.200364 1.002824 -0.709717
H -2.589361 -3.179480 0.099698
H -4.040174 -1.325476 -0.701077
H 1.963988 1.067142 2.023083
H 3.875835 1.086267 -0.092783
H -2.337516 3.001931 0.052325
H -1.549731 2.615443 -1.539877
H -0.686724 3.633305 -0.324784


%chk=000107089-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107089

0 1
S 4.547602 -1.326082 -0.265314
O 1.279026 1.130048 -0.093662
O -1.373656 1.968713 0.095925
O 3.858966 0.986052 -0.228766
O 3.059977 -1.993052 -0.338527
O 5.183038 -1.388089 1.225266
C 0.743432 -0.029604 -0.078315
C -0.685664 -0.335066 0.007605
C -1.745161 0.634820 0.091870
C -1.025339 -1.720421 0.002314
C -3.092782 0.195418 0.165440
C -2.360651 -2.152303 0.075351
C -3.389872 -1.183721 0.156424
C -2.427800 2.990614 0.183706
H 1.409500 -0.927106 -0.135887
H -0.209082 -2.450354 -0.061226
H -3.910673 0.918213 0.229820
H -2.601341 -3.219229 0.069876
H -4.436494 -1.503399 0.213717
H 2.826311 1.111578 -0.195696
H 4.307971 1.429352 0.529959
H -3.000633 2.893426 1.125263
H -3.111650 2.934671 -0.684230
H -1.886527 3.946720 0.171988


