%chk=000187473.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187473

0 1
S 1.452764 0.874386 -1.325154
O 1.860068 -1.218563 0.302288
N 3.724398 -0.021378 -0.344192
C 4.729380 -0.888739 0.349883
C -2.190899 -0.359677 0.025525
C -2.915275 0.860175 -0.027479
C -0.214621 0.789675 -0.761103
C 5.478011 -0.051650 1.390096
C 5.680852 -1.484465 -0.690950
C -0.811645 -0.375384 -0.359968
C -2.247202 2.053657 -0.454893
C -0.922489 2.025327 -0.810116
C -2.855856 -1.549938 0.460370
C -4.294925 0.868317 0.351262
C 2.380664 -0.307542 -0.295091
C -4.180280 -1.512978 0.818632
C -4.908767 -0.288727 0.762430
H 4.169402 -1.718252 0.866801
H 6.187570 -0.670942 1.951773
H 6.048854 0.767575 0.939590
H 4.787103 0.392885 2.118546
H 5.135365 -2.062953 -1.447931
H 6.399640 -2.164525 -0.218341
H 6.258957 -0.718678 -1.219509
H 4.085987 0.784233 -0.850270
H -0.257239 -1.319618 -0.306814
H -2.812036 2.984515 -0.487192
H -0.408539 2.934312 -1.125025
H -2.287842 -2.479247 0.501923
H -4.843930 1.807494 0.306800
H -4.694585 -2.413339 1.151071
H -5.958487 -0.291458 1.052438


%chk=000187473-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187473

0 1
S 1.439676 0.517168 -1.786159
O 1.877130 -1.107163 0.470931
N 3.758990 -0.274170 -0.636938
C 4.769023 -0.970862 0.205738
C -2.224371 -0.395461 -0.024569
C -2.860347 0.905890 0.028551
C -0.234427 0.621376 -1.032731
C 4.978502 -0.228644 1.546025
C 6.074953 -1.116266 -0.598743
C -0.906376 -0.513752 -0.576952
C -2.140805 2.046010 -0.461347
C -0.849529 1.914104 -0.973389
C -2.938484 -1.538478 0.467839
C -4.183897 1.012784 0.569589
C 2.411132 -0.421235 -0.431126
C -4.227321 -1.403842 0.989081
C -4.855797 -0.117938 1.040330
H 4.352250 -1.972103 0.422665
H 5.687971 -0.785267 2.185284
H 5.386763 0.784676 1.375687
H 4.021830 -0.138332 2.087688
H 5.907225 -1.667754 -1.540802
H 6.824606 -1.667052 -0.004768
H 6.506203 -0.125287 -0.840676
H 4.085293 0.390641 -1.342403
H -0.428533 -1.496147 -0.622323
H -2.614339 3.034063 -0.420090
H -0.295816 2.789273 -1.327987
H -2.453675 -2.521108 0.431658
H -4.662768 1.998668 0.609559
H -4.763830 -2.282647 1.363355
H -5.866837 -0.026647 1.452424


