%chk=000217842.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217842

0 1
S 0.422933 1.492141 0.001938
S 3.307413 0.103242 -0.307244
O -0.652241 1.746668 1.278478
O 3.697962 0.840033 1.121122
O 1.639592 2.044235 0.580186
O -0.213406 2.001821 -1.164579
O 4.383308 -0.815530 -0.555049
O 2.897095 1.090613 -1.271104
C 0.569092 -0.238330 0.031843
C -0.563336 -1.050508 0.110520
C 1.847673 -0.825097 0.048564
C -1.945847 -0.524147 0.027790
C -0.407206 -2.451026 0.274143
C 1.996769 -2.192162 0.215891
C 0.856822 -3.012533 0.344803
C -2.809553 -0.673792 1.125603
C -2.408715 0.081894 -1.150163
C -4.127198 -0.218813 1.042026
C -3.730443 0.529963 -1.227863
C -4.589684 0.379838 -0.135182
H -1.299013 -3.079008 0.339889
H 2.994789 -2.651641 0.232794
H 0.980548 -4.088503 0.484835
H -2.446781 -1.128765 2.046276
H -1.737213 0.225540 -2.000708
H -4.793820 -0.326235 1.896396
H -4.084874 1.006782 -2.141687
H -5.617839 0.734533 -0.197952
H -0.414231 2.466764 1.885615
H 3.328203 1.764521 1.243619


%chk=000217842-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217842

0 1
S 0.466561 1.670993 0.079427
S 3.486502 0.031848 -0.511509
O -0.852561 1.807735 1.367537
O 4.038281 0.946410 0.942799
O 1.761000 2.292356 0.856053
O -0.029633 2.342794 -1.286707
O 4.576406 -1.134960 -0.711323
O 3.058161 1.029260 -1.710616
C 0.583097 -0.258415 0.068626
C -0.599375 -1.031910 0.218992
C 1.858777 -0.847841 0.052227
C -1.996253 -0.528561 0.083397
C -0.401241 -2.423474 0.470534
C 2.026421 -2.220866 0.280618
C 0.877544 -3.004153 0.529308
C -2.966644 -0.874782 1.060854
C -2.392119 0.231971 -1.048952
C -4.304191 -0.453526 0.919248
C -3.733613 0.646342 -1.189594
C -4.692205 0.309501 -0.207590
H -1.291748 -3.049827 0.583436
H 3.032201 -2.652573 0.227149
H 0.984428 -4.075280 0.725012
H -2.663748 -1.441258 1.948898
H -1.665150 0.483937 -1.827246
H -5.040585 -0.712817 1.687467
H -4.026988 1.230531 -2.068070
H -5.731794 0.636507 -0.318487
H -0.596021 2.619647 1.899885
H 3.315290 1.662910 1.059428


