%chk=000195185.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195185

0 1
S -6.285464 0.106546 1.749734
O 6.638345 0.407937 0.291271
C -2.010205 0.246963 -0.282944
C -1.210179 -0.999441 0.221251
C 0.248549 -0.967808 -0.251538
C 0.927643 0.306547 0.321363
C -3.451830 -0.125629 0.201954
C -1.380572 1.477336 0.397580
C 2.396811 0.428403 -0.211737
C -2.091471 -2.191399 -0.184934
C 0.112038 1.589082 0.045998
C -3.538241 -1.656940 -0.066050
C 1.005458 -2.218789 0.234604
C -1.964568 0.405958 -1.810762
C -4.611830 0.660908 -0.443608
C 3.124095 -0.904907 -0.049244
C 3.109707 1.528869 0.622827
C 2.490093 -2.071119 0.134699
C 2.422616 0.788471 -1.709289
C 4.623411 -0.876514 -0.186731
C 4.617937 1.596972 0.385525
C 5.253704 0.233249 0.667713
C -5.986090 0.107223 -0.044232
C -4.522311 2.159213 -0.127495
H -1.196844 -0.966277 1.341948
H 0.287235 -0.935292 -1.365635
H 0.986540 0.177009 1.431127
H -3.495609 0.039870 1.305424
H -1.509473 1.414645 1.493705
H -1.906375 2.400741 0.084799
H -1.925445 -3.062836 0.466183
H -1.872925 -2.523155 -1.212820
H 0.210549 1.869098 -1.023174
H 0.552023 2.428727 0.617608
H -4.100672 -1.871766 -0.988289
H -4.076703 -2.156632 0.755593
H 0.673015 -3.100098 -0.349931
H 0.739374 -2.444083 1.289478
H -2.464253 1.323742 -2.133726
H -0.931560 0.450538 -2.176769
H -2.447327 -0.436443 -2.316554
H -4.539202 0.543101 -1.558377
H 2.916174 1.350741 1.699112
H 2.660230 2.513661 0.392491
H 3.039440 -3.006771 0.233250
H 1.857125 1.704467 -1.913729
H 3.446901 0.948448 -2.063451
H 1.985444 -0.013748 -2.314439
H 5.069848 -1.854999 0.072293
H 4.885082 -0.708113 -1.254634
H 4.847068 1.904100 -0.654655
H 5.083808 2.369334 1.026696
H 5.223832 -0.023812 1.748479
H -6.792232 0.670785 -0.549837
H -6.097018 -0.947638 -0.366734
H -4.513781 2.357550 0.949403
H -3.592144 2.588540 -0.529144
H -5.355516 2.716126 -0.567220
H 7.141379 -0.413529 0.421326
H -6.243535 1.432737 1.991752


%chk=000195185-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195185

0 1
S -6.151105 0.180036 2.178590
O 6.763962 0.318892 0.631464
C -2.049473 0.267564 -0.416352
C -1.215597 -0.971185 0.052520
C 0.268742 -0.958287 -0.364956
C 0.949936 0.340496 0.168809
C -3.459438 -0.132762 0.158979
C -1.376462 1.513450 0.217713
C 2.462143 0.451548 -0.262851
C -2.086949 -2.187786 -0.337648
C 0.122377 1.611584 -0.173924
C -3.550899 -1.677653 -0.129596
C 0.999999 -2.204026 0.188684
C -2.111122 0.394718 -1.962487
C -4.718008 0.632752 -0.333523
C 3.175270 -0.900241 -0.052975
C 3.161394 1.523598 0.646346
C 2.505425 -2.065387 0.161082
C 2.602868 0.864632 -1.761549
C 4.699798 -0.882920 -0.105385
C 4.700691 1.565513 0.519440
C 5.306163 0.192782 0.825878
C -6.016218 0.052035 0.281095
C -4.655476 2.163511 -0.112904
H -1.219962 -0.920606 1.167531
H 0.342245 -0.979676 -1.472398
H 0.951323 0.242792 1.279934
H -3.409800 0.008278 1.260575
H -1.467078 1.442487 1.322426
H -1.882589 2.449012 -0.085011
H -1.865557 -3.078917 0.276281
H -1.910538 -2.470706 -1.393522
H 0.191679 1.821227 -1.258048
H 0.562182 2.489093 0.338203
H -4.163967 -1.867139 -1.033142
H -4.045111 -2.203862 0.707106
H 0.698309 -3.104986 -0.382803
H 0.665718 -2.391240 1.234218
H -2.664954 1.305926 -2.257145
H -1.108255 0.463557 -2.418105
H -2.623236 -0.469193 -2.423662
H -4.820706 0.450138 -1.427314
H 2.894722 1.311015 1.702682
H 2.753862 2.524750 0.410263
H 3.087553 -2.985466 0.324953
H 2.288655 1.912037 -1.921869
H 3.647584 0.780385 -2.107326
H 1.988968 0.214107 -2.410236
H 5.091080 -1.885851 0.158980
H 5.060480 -0.656470 -1.130497
H 5.009266 1.862485 -0.501253
H 5.121441 2.316582 1.213398
H 5.087836 -0.080800 1.883442
H -6.906030 0.550536 -0.140669
H -6.105027 -1.030360 0.095004
H -4.377235 2.404464 0.929622
H -3.912482 2.638639 -0.775145
H -5.636375 2.631224 -0.325971
H 7.186373 -0.561866 0.799991
H -6.376297 1.545436 2.230565


