%chk=000225750.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225750

0 1
S -6.569698 -1.850575 -0.304076
O -3.197094 0.057025 -1.932580
O 0.576524 -2.454009 0.366334
O -5.106419 0.306277 0.954332
O 6.574223 -0.327057 -0.724232
C -0.961169 1.229713 -0.364566
C -1.857244 0.022491 0.057955
C 0.427259 1.126467 0.277589
C 1.111449 -0.171745 -0.234297
C -3.232351 0.461275 -0.556917
C 2.524215 -0.369451 0.404045
C -1.834369 2.460148 -0.068422
C -1.241330 -1.244411 -0.539993
C -3.270061 2.001775 -0.410665
C 1.299505 2.339759 -0.076786
C 0.198104 -1.390734 -0.072079
C -2.011064 -0.134243 1.574249
C 3.353727 0.907654 0.245176
C 2.682191 2.214934 0.566060
C 3.217821 -1.547171 -0.334418
C 2.418803 -0.671930 1.907147
C -4.452789 -0.232603 0.090339
C 4.710244 -1.649018 -0.036613
C 4.653432 0.888543 -0.089844
C 5.425300 -0.348305 -0.334686
C -4.781862 -1.607787 -0.408087
H -0.831512 1.182092 -1.479256
H 0.326170 1.068809 1.390015
H 1.267796 -0.056613 -1.341363
H -1.533306 3.331854 -0.670969
H -1.758304 2.768811 0.988470
H -1.288455 -1.213081 -1.650987
H -1.816047 -2.150364 -0.262751
H -3.982477 2.301185 0.384732
H -3.631183 2.474807 -1.338648
H 0.811884 3.273015 0.264988
H 1.401576 2.438518 -1.175398
H -1.036206 -0.191928 2.076401
H -2.553849 0.706529 2.026404
H -2.551746 -1.049734 1.841733
H 2.602073 2.304183 1.672138
H 3.313179 3.073540 0.253202
H 3.071644 -1.444045 -1.427107
H 2.718129 -2.500880 -0.051534
H 3.409037 -0.744642 2.371113
H 1.855069 0.095311 2.445602
H 1.914217 -1.636089 2.074530
H -3.770407 0.632296 -2.483272
H 5.168025 -2.474341 -0.620157
H 4.886569 -1.917596 1.025888
H 5.240402 1.802355 -0.200411
H -4.242772 -2.380396 0.178562
H -4.460852 -1.757086 -1.465475
H -6.798401 -1.188733 0.857686


%chk=000225750-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225750

0 1
S -6.102100 -1.004083 -2.054646
O -3.044446 0.050520 -1.832080
O 0.593063 -2.431710 0.985786
O -5.067542 -0.068639 1.189659
O 6.550140 -0.351332 -1.275721
C -1.006269 1.165747 -0.170228
C -1.885108 -0.035263 0.306822
C 0.427358 1.134891 0.396257
C 1.118763 -0.219565 -0.009761
C -3.250197 0.351828 -0.402223
C 2.616282 -0.356615 0.465752
C -1.893428 2.405676 0.098589
C -1.231594 -1.350869 -0.188041
C -3.351757 1.894986 -0.154778
C 1.261830 2.320004 -0.138371
C 0.209566 -1.426232 0.328449
C -2.061153 -0.088085 1.845384
C 3.380116 0.915085 0.045973
C 2.727922 2.251911 0.347583
C 3.244697 -1.604131 -0.234939
C 2.718086 -0.491659 2.020334
C -4.467978 -0.422475 0.136658
C 4.784983 -1.644845 -0.166579
C 4.627446 0.872143 -0.523306
C 5.408315 -0.367199 -0.720463
C -4.958567 -1.630394 -0.654395
H -0.923007 1.059011 -1.272795
H 0.393456 1.208169 1.502807
H 1.141582 -0.197095 -1.126085
H -1.634488 3.250022 -0.562635
H -1.775500 2.756697 1.141108
H -1.236745 -1.352542 -1.294901
H -1.762467 -2.249566 0.173887
H -4.012251 2.088628 0.707321
H -3.805995 2.374697 -1.040295
H 0.808714 3.274476 0.190189
H 1.236721 2.311482 -1.247568
H -1.083366 -0.193432 2.346985
H -2.561050 0.809181 2.245126
H -2.669384 -0.959624 2.143748
H 2.737839 2.413509 1.446852
H 3.322690 3.070827 -0.095951
H 2.944899 -1.593702 -1.303514
H 2.821430 -2.518162 0.212415
H 3.775988 -0.521741 2.336199
H 2.245451 0.360328 2.541216
H 2.223766 -1.419491 2.349051
H -3.883305 0.259756 -2.325794
H 5.190332 -2.508872 -0.722088
H 5.124038 -1.759863 0.883474
H 5.131998 1.800544 -0.822609
H -5.535547 -2.309253 -0.010917
H -4.147697 -2.150687 -1.184312
H -7.028929 -0.408197 -1.213529


