%chk=000292692.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292692

0 1
S 4.547715 0.124768 0.148965
O -2.042566 1.994368 -0.458818
O 4.949849 -0.035136 -1.487020
O 4.999060 1.456171 0.474283
O 5.120959 -1.018881 0.806284
N -1.361258 -0.239082 -0.162056
N -1.985561 -1.487895 -0.056749
C -3.692832 0.131719 -0.326425
C -4.601913 0.658656 0.791042
C -3.289166 -1.330261 -0.141265
C -2.327991 0.835868 -0.332530
C 0.061644 -0.163322 -0.081890
C -5.033469 2.097548 0.537996
C -4.262343 -2.438030 -0.076715
C 0.689290 1.096493 -0.181503
C 0.833566 -1.332936 0.095289
C 2.848951 0.017272 0.065503
C 2.076516 1.173927 -0.108156
C 2.217875 -1.232074 0.166298
H -4.182796 0.279945 -1.320901
H -4.082175 0.583219 1.768689
H -5.493946 0.003465 0.869117
H -4.167189 2.761672 0.387472
H -5.666178 2.190096 -0.352022
H -5.601402 2.497016 1.386876
H -4.846642 -2.403678 0.857445
H -3.768760 -3.425865 -0.107390
H -4.974558 -2.403725 -0.915415
H 0.099141 2.009031 -0.316639
H 0.347820 -2.308316 0.174804
H 2.564780 2.154329 -0.180646
H 2.819211 -2.139146 0.309028
H 5.801768 0.334180 -1.753951


%chk=000292692-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292692

0 1
S 4.666354 0.115889 0.162420
O -2.093125 2.078916 -0.462229
O 5.000226 -0.050760 -1.662184
O 5.137847 1.592853 0.627644
O 5.241139 -1.202035 0.906704
N -1.374807 -0.183416 -0.172946
N -1.982996 -1.485458 -0.067529
C -3.700062 0.138635 -0.307874
C -4.644586 0.665094 0.820419
C -3.290327 -1.314410 -0.149604
C -2.334340 0.849560 -0.336592
C 0.040498 -0.097398 -0.105812
C -5.142177 2.103183 0.567386
C -4.226408 -2.481953 -0.080992
C 0.692763 1.164383 -0.204219
C 0.794668 -1.290860 0.070067
C 2.810729 0.030212 0.038996
C 2.097424 1.226851 -0.134214
C 2.197590 -1.229537 0.140224
H -4.209985 0.299679 -1.279167
H -4.113325 0.608128 1.789721
H -5.509388 -0.023148 0.887507
H -4.296878 2.803110 0.462272
H -5.744189 2.157987 -0.358906
H -5.776497 2.442165 1.405883
H -4.901283 -2.400850 0.792049
H -3.660053 -3.423182 0.000751
H -4.867875 -2.528403 -0.981144
H 0.102716 2.072820 -0.336799
H 0.271164 -2.245179 0.146206
H 2.621223 2.185462 -0.197334
H 2.798473 -2.132244 0.285937
H 5.992885 -0.004696 -1.787643


