%chk=000188877.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188877

0 1
S 3.029577 0.979218 -0.522994
O 2.023123 -0.617258 1.349033
N 0.701542 -0.280067 -0.514689
C -0.434340 -1.137497 -0.059258
C -1.702387 -0.300568 -0.076127
C -0.542622 -2.378302 -0.949146
C -2.321310 0.059832 -1.281342
C -2.251712 0.129162 1.140661
C -3.482888 0.837248 -1.268104
C -3.414234 0.904947 1.150114
C 1.821792 -0.115058 0.266702
C -4.031775 1.259944 -0.053373
C 4.384450 0.972389 0.706661
C 5.642717 0.481195 0.031259
H -0.209765 -1.472545 0.995975
H -1.410576 -2.985801 -0.662810
H 0.350023 -3.010548 -0.854135
H -0.653091 -2.132516 -2.010926
H 0.593086 0.189799 -1.410659
H -1.903474 -0.267811 -2.231321
H -1.771563 -0.136131 2.082612
H -3.960762 1.114102 -2.206432
H -3.837429 1.235307 2.097665
H -4.936528 1.864942 -0.044550
H 4.491332 2.003828 1.092849
H 4.098112 0.327286 1.568776
H 5.538381 -0.549087 -0.338842
H 5.932537 1.104264 -0.825514
H 6.489984 0.483824 0.732214


%chk=000188877-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188877

0 1
S 2.992840 1.484391 0.073931
O 2.203702 -0.973155 1.113793
N 0.691450 0.099829 -0.308297
C -0.367510 -0.943552 -0.221784
C -1.741432 -0.258834 -0.179001
C -0.185885 -1.998672 -1.333661
C -2.784119 -0.578079 -1.082674
C -1.984464 0.722833 0.819429
C -4.039740 0.068287 -0.993113
C -3.235187 1.368477 0.911378
C 1.882352 -0.011057 0.367475
C -4.270359 1.042921 0.002450
C 4.518311 0.861233 1.010630
C 5.514573 0.133602 0.099098
H -0.191143 -1.445526 0.749583
H -0.914216 -2.821469 -1.218902
H 0.827357 -2.428462 -1.263503
H -0.307889 -1.557768 -2.339691
H 0.531720 0.902159 -0.922010
H -2.626915 -1.332762 -1.859979
H -1.184097 0.978297 1.524418
H -4.835465 -0.191032 -1.700597
H -3.404874 2.120816 1.689765
H -5.243131 1.542344 0.071771
H 4.950083 1.760338 1.480048
H 4.120348 0.189713 1.790609
H 5.054673 -0.769529 -0.337320
H 5.861913 0.781095 -0.724956
H 6.399303 -0.182341 0.685413


