%chk=000207886.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207886

0 1
S 1.997545 -0.341924 1.047155
O 5.067095 -0.567989 -1.271840
O 4.785279 -0.858953 0.860021
N -2.950872 0.704912 0.772035
N -2.255422 -0.266200 -1.293709
N -0.638969 0.248919 0.574036
N 0.902056 0.239262 -1.285008
N 4.377103 -0.595713 -0.263873
C -3.781666 -0.543903 0.573220
C -1.858440 0.687408 -0.241420
C -3.218477 -1.241831 -0.698627
C -3.653092 -1.417234 1.819271
C -3.740428 1.963897 0.761741
C 0.586160 0.091771 0.041884
C 2.989196 -0.304830 -0.379546
C 2.239469 0.022948 -1.503804
H -4.856817 -0.282553 0.414249
H -1.605028 1.680391 -0.703473
H -2.760334 -2.222187 -0.464963
H -4.017540 -1.423822 -1.447985
H -1.473412 -0.705738 -1.790508
H -3.971234 -0.870894 2.717581
H -4.273302 -2.317184 1.740454
H -2.619675 -1.737325 1.997308
H -4.260441 2.168627 -0.188095
H -3.075198 2.814810 0.987343
H -4.491113 1.919934 1.569616
H -0.800113 0.084807 1.575080
H 2.638268 0.111495 -2.518944


%chk=000207886-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207886

0 1
S 2.242762 -0.165514 1.090795
O 5.102430 -0.273510 -1.734126
O 5.173090 -0.481630 0.559995
N -2.890773 0.535661 0.753113
N -2.132089 -0.539382 -1.149751
N -0.519547 0.187186 0.638169
N 0.911850 0.171494 -1.258328
N 4.537156 -0.305904 -0.563312
C -3.870166 -0.551100 0.409145
C -1.779442 0.493004 -0.200852
C -3.016857 -1.503361 -0.466601
C -4.479132 -1.211903 1.654366
C -3.467365 1.861662 1.039897
C 0.707848 0.090478 0.078616
C 3.122954 -0.136717 -0.502223
C 2.249728 0.053018 -1.570451
H -4.682133 -0.124444 -0.224373
H -1.560324 1.449437 -0.710641
H -2.477247 -2.234617 0.178961
H -3.631907 -2.060676 -1.192374
H -1.381636 -0.862051 -1.767468
H -5.046439 -0.482394 2.259942
H -5.177291 -2.018703 1.363925
H -3.685571 -1.642916 2.289962
H -4.020680 2.291479 0.172806
H -2.670116 2.566936 1.331565
H -4.166553 1.783097 1.890349
H -0.689045 0.051195 1.637577
H 2.577093 0.101079 -2.609484


