%chk=000290197.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290197

0 1
S -0.370682 2.266755 0.028649
O 0.923260 -2.583691 -0.013635
N 2.212104 1.346248 0.013732
N 2.597726 -1.060034 -0.009398
N 4.414944 0.514107 0.003789
C -1.130135 -0.213466 -0.007509
C -1.990493 -1.431414 -0.048475
C -3.439469 -1.096155 0.343173
C -3.933592 0.187104 -0.343758
C -3.075063 1.410832 0.041236
C -1.638808 1.052460 0.012333
C 0.317630 -0.237576 -0.006721
C 0.877471 1.047203 0.009961
C 1.165749 -1.396621 -0.011475
C 3.051433 0.274066 0.002422
H -1.953636 -1.866431 -1.070878
H -1.576654 -2.222078 0.614003
H -4.101279 -1.942614 0.082903
H -3.505550 -0.977638 1.442464
H -4.989680 0.375401 -0.078884
H -3.906670 0.051668 -1.442591
H -3.354824 1.761966 1.058405
H -3.296828 2.252393 -0.646271
H 3.254030 -1.844749 -0.013884
H 4.747367 1.469669 0.011473
H 5.093246 -0.223405 -0.004764


%chk=000290197-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290197

0 1
S -0.342237 2.335315 0.065969
O 0.922058 -2.627942 -0.059839
N 2.256438 1.347678 0.030125
N 2.612930 -1.017312 -0.026976
N 4.444152 0.506263 0.002793
C -1.119857 -0.230953 -0.001130
C -2.015345 -1.456541 -0.028559
C -3.471323 -1.098547 0.358440
C -3.954957 0.179735 -0.368150
C -3.105985 1.414067 0.042243
C -1.643250 1.049647 0.031224
C 0.330349 -0.242793 -0.008709
C 0.918595 1.045262 0.025089
C 1.216433 -1.393776 -0.033816
C 3.080563 0.291961 0.002259
H -1.989627 -1.901894 -1.043709
H -1.604605 -2.233186 0.640938
H -4.138092 -1.948465 0.120072
H -3.533556 -0.936063 1.453434
H -5.019982 0.375790 -0.142101
H -3.873447 0.028627 -1.462587
H -3.407134 1.756239 1.054400
H -3.307846 2.258507 -0.645306
H 3.255148 -1.815802 -0.045313
H 4.756275 1.474103 0.024921
H 5.125902 -0.245922 -0.019410


