%chk=000216678.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216678

0 1
S -1.012053 2.009761 -0.116585
O 3.505249 -0.117577 0.016233
N -1.949979 -0.951751 -0.125721
N 1.341765 0.826026 -0.020711
N -4.199452 -0.376999 0.090928
C -0.562659 -0.707418 -0.010851
C 0.008770 0.581245 -0.025997
C -2.551007 1.384437 0.608582
C -2.830676 -0.015626 0.133901
C 0.315683 -1.820247 0.035746
C 2.151422 -0.269706 0.012036
C 1.684330 -1.610343 0.050605
C 4.025956 1.244995 -0.021134
H -3.345824 2.111177 0.345704
H -2.491165 1.393290 1.720630
H -0.103597 -2.829141 0.053195
H 2.398842 -2.429082 0.086106
H -4.837755 0.324994 -0.254810
H -4.395697 -1.298376 -0.293136
H 3.687659 1.797393 0.861233
H 3.700537 1.742739 -0.940067
H 5.106150 1.064911 -0.008087


%chk=000216678-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216678

0 1
S -1.040167 2.069359 -0.180888
O 3.548500 -0.119131 0.042351
N -1.972103 -0.980113 -0.153856
N 1.353522 0.775030 -0.039699
N -4.193499 -0.283481 -0.218303
C -0.594372 -0.722769 0.012983
C 0.015590 0.567498 -0.039971
C -2.538899 1.315386 0.694020
C -2.864245 -0.036460 0.072066
C 0.300452 -1.828730 0.126618
C 2.170030 -0.300038 0.050148
C 1.688379 -1.632679 0.155439
C 4.030632 1.270251 -0.080524
H -3.354318 2.047923 0.588198
H -2.288295 1.196474 1.762114
H -0.132679 -2.832400 0.170601
H 2.395977 -2.460559 0.237862
H -4.919785 0.405358 -0.046227
H -4.436389 -1.185449 -0.626391
H 3.667688 1.885663 0.760561
H 3.683521 1.721696 -1.025947
H 5.126959 1.181870 -0.063357


