%chk=000245188.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245188

0 1
S -2.139076 1.450029 -0.271188
S -1.652480 -1.330288 -0.559245
O 0.547615 0.843629 -1.175315
O 1.620425 -0.760838 1.775835
O 3.336902 -1.910756 0.100545
O 4.659888 0.203846 -0.819605
C 0.344916 0.352660 0.146848
C -1.138682 0.103885 0.446751
C 1.255299 -0.880497 0.388989
C 2.534389 -0.863910 -0.479526
C -1.407167 -0.093179 1.911462
C 3.307217 0.464745 -0.417451
C -1.449994 2.994149 0.428076
C -3.452313 -1.504136 -0.273402
C -2.438864 4.086284 0.083620
C -3.802913 -2.919932 -0.673422
H 0.733032 1.191170 0.787718
H 0.741770 -1.862745 0.267437
H 2.311120 -1.164853 -1.526057
H -1.218354 0.816951 2.499636
H -0.743035 -0.868590 2.340283
H -2.442151 -0.395194 2.123075
H 3.417117 0.830806 0.622889
H 2.842554 1.245951 -1.045225
H -0.074510 0.439572 -1.827604
H 2.384124 -1.373991 1.953743
H -0.457454 3.183466 -0.025846
H -1.313056 2.895504 1.519309
H -3.997153 -0.757097 -0.882833
H -3.690948 -1.303825 0.788586
H 4.299501 -1.662783 0.040369
H -2.581434 4.192025 -1.001593
H -3.429234 3.907907 0.525617
H -2.090911 5.060418 0.455206
H -3.571153 -3.127436 -1.727890
H -3.269595 -3.669476 -0.070990
H -4.878079 -3.107934 -0.541438
H 4.715490 0.114762 -1.794362


%chk=000245188-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245188

0 1
S -2.139086 1.421841 -0.527928
S -1.712904 -1.568659 -0.644720
O 0.554077 0.357914 -1.551293
O 1.591369 -0.760049 1.779679
O 3.573329 -1.806404 0.338544
O 4.837099 0.369677 -0.723931
C 0.392082 0.215372 -0.102208
C -1.101142 -0.015610 0.280534
C 1.359306 -0.906950 0.336226
C 2.722974 -0.841644 -0.393272
C -1.330570 -0.078478 1.792070
C 3.408402 0.536428 -0.350305
C -1.727821 2.935582 0.563309
C -3.417854 -1.821218 0.159007
C -2.328169 4.188204 -0.093649
C -4.213243 -2.819388 -0.695378
H 0.710153 1.146033 0.421179
H 0.911658 -1.897924 0.120006
H 2.593619 -1.165615 -1.443300
H -0.918284 0.821159 2.284296
H -0.796717 -0.944259 2.217813
H -2.404543 -0.141873 2.031566
H 3.437343 0.924681 0.680707
H 2.895561 1.250059 -1.019035
H -0.231747 0.891518 -1.868339
H 2.403991 -1.314348 1.953875
H -0.630769 3.016598 0.649721
H -2.159333 2.759030 1.562043
H -3.910020 -0.833865 0.191210
H -3.269848 -2.197180 1.184559
H 4.514054 -1.525592 0.163699
H -1.892652 4.365578 -1.092780
H -3.423052 4.096068 -0.207372
H -2.125020 5.076892 0.532480
H -4.366711 -2.433321 -1.718155
H -3.696421 -3.793273 -0.768045
H -5.205322 -2.995917 -0.239692
H 4.909011 0.309230 -1.710117


