%chk=000080024.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000080024

0 1
S 2.231766 -0.999516 0.226821
O 1.765222 1.372463 -0.807284
C -0.196791 0.110221 -0.201537
C -1.020132 1.149705 0.264180
C -0.745294 -1.145149 -0.499246
C -2.385633 0.924766 0.446466
C -2.115367 -1.360315 -0.319237
C -2.932970 -0.330417 0.156039
C 1.245821 0.382458 -0.372716
C 3.922565 -0.465522 -0.107540
H -0.587628 2.129044 0.478393
H -0.117355 -1.953849 -0.879224
H -3.024903 1.727478 0.811671
H -2.544630 -2.334496 -0.550098
H -3.999564 -0.504007 0.298517
H 4.502230 -0.457070 0.823096
H 3.946238 0.551737 -0.534585
H 4.399524 -1.146132 -0.822317


%chk=000080024-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080024

0 1
S 2.336652 -1.230423 -0.355085
O 1.797452 1.426310 0.075167
C -0.192482 0.044052 -0.042557
C -1.041411 1.169037 0.150745
C -0.766138 -1.245782 -0.197077
C -2.440221 1.004500 0.187219
C -2.166701 -1.406090 -0.159422
C -3.006753 -0.283343 0.032099
C 1.280288 0.291718 -0.072994
C 4.030504 -0.419677 -0.317816
H -0.582191 2.155887 0.268612
H -0.124742 -2.121191 -0.345636
H -3.088718 1.874659 0.335498
H -2.603803 -2.403114 -0.278995
H -4.094548 -0.411699 0.060337
H 4.620760 -0.879952 0.487140
H 3.872310 0.654350 -0.121414
H 4.512843 -0.567842 -1.294422


