%chk=000208055.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208055

1 1
S -5.239337 0.365743 -1.883337
O 5.396074 -0.095946 -0.166244
O -0.759558 0.073851 -1.252963
N 2.500865 0.088836 -0.075299
C 3.333710 -0.521893 1.051317
C 3.375389 1.062158 -0.874267
C 1.331798 0.891050 0.519103
C 1.970256 -0.988147 -0.993354
C 4.655014 -1.107957 0.528527
C 4.698924 0.414271 -1.310644
C 0.328741 0.036204 1.308730
C -1.116329 0.481333 1.067210
C -1.578143 0.287835 -0.370018
C -3.014084 0.389371 -0.644599
C -4.027817 0.731476 0.328384
C -3.539679 0.164483 -1.901352
C -5.284492 0.758623 -0.196999
H 2.746378 -1.302233 1.585035
H 3.562373 0.273461 1.802791
H 3.602308 1.953092 -0.239209
H 2.812587 1.434445 -1.762131
H 1.738167 1.701690 1.164256
H 0.802086 1.393344 -0.334684
H 2.763185 -1.445260 -1.606955
H 1.463077 -1.794787 -0.432063
H 1.187989 -0.580148 -1.681813
H 5.339363 -1.374047 1.364296
H 4.510181 -1.991757 -0.118060
H 4.561984 -0.382760 -2.063938
H 5.410102 1.172917 -1.706459
H 0.550133 0.096319 2.395424
H 0.410350 -1.040094 1.042163
H -1.787806 -0.082725 1.754718
H -1.260327 1.547182 1.350423
H -3.796124 0.944977 1.363311
H -2.985038 -0.102372 -2.792949
H -6.212599 0.983962 0.306849


%chk=000208055-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208055

1 1
S -5.448938 0.757775 -1.850753
O 5.500247 0.188009 -0.004794
O -0.991598 -0.390756 -1.289297
N 2.546560 0.002819 -0.117737
C 3.390385 -0.450656 1.093069
C 3.363296 1.055646 -0.911314
C 1.252730 0.699345 0.376202
C 2.182441 -1.177676 -1.029811
C 4.790613 -0.908845 0.662417
C 4.790500 0.576870 -1.227424
C 0.296440 -0.214055 1.170472
C -1.163543 0.279675 1.052296
C -1.737124 0.074902 -0.364456
C -3.148109 0.428856 -0.598465
C -4.069286 0.965621 0.392112
C -3.750653 0.264450 -1.851483
C -5.333514 1.198504 -0.106984
H 2.836598 -1.250778 1.610578
H 3.476698 0.425942 1.758117
H 3.405806 1.955856 -0.275354
H 2.797313 1.283493 -1.831046
H 1.580860 1.562108 0.983642
H 0.758657 1.064139 -0.537732
H 2.997405 -1.357178 -1.743361
H 2.033674 -2.080199 -0.419504
H 1.242255 -0.938542 -1.552266
H 5.384382 -1.153928 1.556818
H 4.752165 -1.806743 0.010898
H 4.802271 -0.254416 -1.962907
H 5.359495 1.418021 -1.654070
H 0.587582 -0.251131 2.235150
H 0.325052 -1.243686 0.774453
H -1.796223 -0.273208 1.772456
H -1.256463 1.348492 1.332810
H -3.806746 1.169324 1.432492
H -3.287092 -0.121830 -2.757690
H -6.214434 1.590277 0.397665


