%chk=000230327.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230327

0 1
S -2.403478 1.346081 0.324247
O 2.845328 -0.347666 -1.013209
O 2.752369 -0.170106 1.216927
N -0.032107 -0.907134 0.063399
N -1.876505 -2.312807 -0.118028
C 0.328130 1.491758 0.739053
C 0.736253 0.319013 -0.177431
C -0.850822 2.280584 0.201831
C -2.185553 0.014972 -0.875800
C -1.287466 -1.026336 -0.265467
C 2.174200 -0.094596 0.163817
H 1.195855 2.173505 0.877667
H 0.115957 1.100960 1.761402
H 0.708136 0.633813 -1.257944
H -1.012791 3.200614 0.805001
H -0.684257 2.618862 -0.837988
H -1.766697 0.381159 -1.835562
H -3.194982 -0.369635 -1.136225
H -1.287708 -3.001806 0.347961
H -2.817260 -2.318474 0.255900
H 3.774299 -0.667163 -0.868451


%chk=000230327-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230327

0 1
S -2.553014 1.395565 0.257787
O 2.698333 -0.721613 -1.059613
O 2.959989 0.347461 0.980934
N 0.020828 -0.939277 0.135079
N -1.880119 -2.271035 0.034956
C 0.313910 1.495938 0.803187
C 0.730391 0.333228 -0.138990
C -0.886541 2.309398 0.292763
C -2.085282 -0.014200 -0.921324
C -1.233597 -1.071808 -0.231391
C 2.221924 0.015381 0.029458
H 1.170633 2.189969 0.911251
H 0.111286 1.084673 1.807751
H 0.600937 0.666948 -1.195462
H -1.085293 3.168608 0.956318
H -0.705195 2.696247 -0.727191
H -1.544498 0.430249 -1.775239
H -3.039569 -0.418790 -1.296213
H -1.358035 -2.993295 0.529005
H -2.875686 -2.390546 -0.125427
H 3.649497 -0.967503 -0.896540


