%chk=000223620.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223620

0 1
S -1.490701 1.368334 -1.037711
O -1.127363 1.067502 -2.406680
O -2.478224 2.414722 -0.816508
O 2.527947 -1.189948 -0.248199
O 1.020463 -2.889454 -0.099278
N 0.337118 -0.663677 0.200969
C -0.061876 1.740832 -0.128345
C -2.011007 -0.080120 -0.240882
C 0.749927 0.715649 0.372205
C -1.076818 -0.991777 0.268199
C 0.296341 3.074734 0.090165
C -3.376639 -0.358893 -0.129663
C 1.928595 1.017613 1.078457
C -1.498904 -2.194240 0.861116
C 1.273813 -1.706271 -0.054792
C 1.462995 3.385518 0.789999
C -3.807964 -1.546151 0.464087
C 2.277212 2.353533 1.275260
C -2.865469 -2.462623 0.947835
C 3.558956 -2.177725 -0.648237
C 4.794860 -1.324794 -0.811926
H -0.349004 3.878306 -0.285481
H -4.110582 0.363643 -0.506974
H 2.571880 0.219832 1.454231
H -0.771735 -2.922531 1.230568
H 1.740378 4.424830 0.957483
H -4.871987 -1.761603 0.546696
H 3.191867 2.595606 1.820006
H -3.200269 -3.397319 1.402853
H 3.631109 -2.928175 0.157055
H 3.217199 -2.651551 -1.585220
H 5.629834 -1.911715 -1.216235
H 4.612224 -0.485779 -1.501533
H 5.119823 -0.884707 0.140080


%chk=000223620-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223620

0 1
S -1.369202 1.280643 -1.299460
O -0.735279 0.725398 -2.697752
O -2.492936 2.469969 -1.331228
O 2.562237 -1.177439 -0.317958
O 0.986655 -2.902884 -0.269516
N 0.370711 -0.674684 0.222814
C 0.018169 1.755588 -0.125061
C -2.002697 -0.161447 -0.274428
C 0.769199 0.699723 0.437434
C -1.035103 -1.010402 0.307953
C 0.263544 3.111013 0.134126
C -3.384539 -0.360490 -0.154378
C 1.835382 1.049521 1.301974
C -1.500073 -2.141331 1.021797
C 1.287851 -1.694992 -0.130054
C 1.340147 3.441274 0.985098
C -3.832566 -1.493321 0.559409
C 2.122570 2.407188 1.554113
C -2.887086 -2.379521 1.129023
C 3.580950 -2.165639 -0.800326
C 4.873287 -1.386289 -1.013056
H -0.380221 3.873706 -0.316642
H -4.076972 0.356192 -0.608394
H 2.433682 0.259913 1.762391
H -0.780483 -2.826416 1.474121
H 1.565700 4.489378 1.204381
H -4.904499 -1.685759 0.666324
H 2.953696 2.659924 2.220914
H -3.232697 -3.260623 1.679699
H 3.679728 -2.960804 -0.039539
H 3.200246 -2.619334 -1.732231
H 5.658403 -2.069556 -1.384745
H 4.729789 -0.584107 -1.756155
H 5.226409 -0.932792 -0.071048


