%chk=000266540.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266540

0 1
S 3.765306 0.591986 -0.788994
O -0.176666 -2.254081 0.341260
O -2.862674 1.235187 -1.078233
N 1.314704 1.467633 -0.195735
N -1.977772 -0.155748 0.532848
N 1.619133 -0.913976 -0.198348
C -0.065345 1.350111 0.112390
C -0.601049 0.091751 0.241575
C -0.807426 2.624870 0.261516
C 0.246551 -1.137008 0.139037
C 2.076794 0.299509 -0.357882
C -3.029932 0.347859 -0.259702
C -4.372385 -0.248025 0.058500
C 4.451654 -1.062318 -0.941043
H 1.718231 2.394450 -0.334575
H -0.183839 3.524813 0.282780
H -1.420822 2.622670 1.178773
H -1.537278 2.741031 -0.576895
H -2.124014 -1.029489 1.056681
H -5.162426 0.293853 -0.487569
H -4.622719 -0.196738 1.126071
H -4.437473 -1.300931 -0.251719
H 3.977576 -1.627782 -1.758366
H 4.302958 -1.654820 -0.023345
H 5.527214 -0.973108 -1.139925


%chk=000266540-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266540

0 1
S 3.834797 0.635177 -0.847679
O -0.237942 -2.227745 0.327343
O -3.109799 1.443085 -0.938480
N 1.317614 1.468283 -0.253138
N -1.975545 -0.199384 0.300900
N 1.621314 -0.894698 -0.239443
C -0.064777 1.399255 0.003564
C -0.618916 0.126857 0.075237
C -0.765486 2.710116 0.242281
C 0.254329 -1.082665 0.062691
C 2.088967 0.325454 -0.400037
C -3.126335 0.399023 -0.220469
C -4.414122 -0.340975 0.134052
C 4.463724 -1.136145 -0.804784
H 1.750513 2.391776 -0.331589
H -0.075899 3.565924 0.129744
H -1.184861 2.739445 1.265148
H -1.618004 2.817408 -0.450964
H -2.054983 -1.170678 0.645805
H -5.272050 0.270766 -0.179654
H -4.484966 -0.543067 1.217648
H -4.461354 -1.310370 -0.396559
H 3.851165 -1.748327 -1.479607
H 4.391109 -1.524375 0.219974
H 5.509809 -1.082441 -1.142885


