%chk=000197373.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197373

0 1
S -1.725456 1.576441 0.069272
O 0.060534 -2.607859 -0.947869
O 2.851141 -1.576829 -0.853915
O 3.164615 0.961849 -1.125204
O 2.301836 2.165569 1.449603
O -2.710802 -1.479809 1.339228
O -2.536573 1.169578 1.448965
O -2.625905 2.052784 -0.927136
O -0.582583 2.324329 0.525574
N -1.158701 0.053265 -0.443564
C 0.660419 -1.627563 -0.082902
C 1.657165 -0.777787 -0.901773
C -0.542735 -0.865503 0.518635
C 1.962792 0.646170 -0.391222
C 2.233448 0.780911 1.117495
C -1.607450 -1.869035 1.024016
H 1.218782 -2.173994 0.719558
H 1.333270 -0.721288 -1.970605
H -0.157750 -0.285324 1.416367
H 1.175801 1.373488 -0.708593
H -1.428900 -0.383333 -1.333034
H 3.232885 0.391620 1.395269
H 1.457940 0.285637 1.731495
H -1.312619 -2.927387 1.070997
H 0.766034 -3.127682 -1.405502
H 3.630766 -1.022790 -1.140782
H 3.579679 1.772719 -0.739355
H 1.403217 2.588504 1.334047
H -3.083049 0.327720 1.442836


%chk=000197373-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197373

0 1
S -2.454547 1.330156 -0.209854
O 0.118937 -2.515224 -0.757216
O 2.608121 -1.453425 -1.260585
O 3.178676 1.164115 -1.180220
O 3.695918 1.676272 1.449309
O -2.727310 -1.558947 1.475617
O -4.028881 0.538847 0.222960
O -2.736576 2.142037 -1.556721
O -1.767153 2.009661 1.088221
N -1.359712 -0.057820 -0.572912
C 0.626953 -1.380173 0.022900
C 1.539984 -0.522306 -0.864947
C -0.631597 -0.663732 0.542163
C 2.153875 0.735028 -0.212612
C 2.840210 0.507093 1.150720
C -1.477064 -1.637767 1.385489
H 1.216518 -1.754523 0.888345
H 0.973423 -0.195506 -1.758632
H -0.331247 0.161004 1.226158
H 1.373838 1.520550 -0.118156
H -1.707894 -0.684329 -1.310965
H 3.537068 -0.344715 1.093775
H 2.106724 0.335050 1.963678
H -0.920625 -2.412673 1.958682
H 0.891863 -2.900191 -1.250213
H 3.300759 -0.896155 -1.709641
H 3.817839 1.740097 -0.676859
H 3.143467 2.413366 1.814382
H -3.763766 -0.271389 0.789035


