%chk=000292421.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292421

0 1
S 5.353551 -1.134921 -0.886212
O 2.451583 -1.779073 -0.000573
N 0.544372 0.215411 -0.073482
N 1.888638 0.479623 -0.103810
C -5.851800 -1.516670 0.105933
C -4.350199 -1.901371 0.118832
C -5.933775 0.026996 -0.016613
C -3.608372 -0.599795 0.005659
C -4.507192 0.493865 -0.071127
C -2.238176 -0.398199 -0.027037
C -4.029530 1.792182 -0.180930
C -1.749550 0.922754 -0.138678
C -2.642000 2.002943 -0.214650
C -0.300398 1.205953 -0.179648
C 4.202760 -0.180248 -0.020129
C 2.795805 -0.622312 -0.029192
C 4.821943 0.860761 0.619390
C 6.240693 0.891185 0.384154
C 6.674830 -0.124060 -0.422195
H -6.350081 -1.861525 1.026142
H -6.371066 -2.002499 -0.735672
H -4.098931 -2.578878 -0.717110
H -4.077859 -2.437537 1.045826
H -6.468152 0.470931 0.842146
H -6.489376 0.329746 -0.922023
H -1.540242 -1.235942 0.031879
H -4.711038 2.636513 -0.240375
H -2.265549 3.020024 -0.300678
H -0.035701 2.266989 -0.300234
H 2.248860 1.434927 -0.209111
H 4.329165 1.586623 1.252627
H 6.876391 1.651954 0.817608
H 7.682198 -0.322649 -0.751117


%chk=000292421-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292421

0 1
S 5.585683 -1.350827 -0.461208
O 2.593822 -1.898971 -0.258270
N 0.565018 0.045428 -0.097045
N 1.912520 0.351567 -0.102386
C -5.917223 -1.440779 0.347787
C -4.500745 -1.917679 -0.103635
C -5.997784 0.056271 -0.090210
C -3.678619 -0.635076 -0.085063
C -4.541313 0.499457 -0.077752
C -2.285783 -0.478949 -0.095686
C -4.002264 1.801200 -0.081084
C -1.730689 0.836476 -0.093512
C -2.598307 1.964900 -0.086765
C -0.281108 1.056471 -0.098794
C 4.274420 -0.179944 -0.050571
C 2.877299 -0.674805 -0.142680
C 4.806254 1.052224 0.333146
C 6.243094 1.098735 0.296646
C 6.812671 -0.101051 -0.109761
H -5.989619 -1.502514 1.449669
H -6.730138 -2.053983 -0.077975
H -4.535221 -2.331537 -1.132015
H -4.086365 -2.707698 0.547362
H -6.643542 0.662832 0.570179
H -6.413159 0.142246 -1.115627
H -1.603971 -1.335906 -0.101307
H -4.658255 2.679264 -0.074250
H -2.167116 2.974281 -0.082111
H 0.060302 2.113607 -0.106223
H 2.225762 1.334080 -0.117452
H 4.200979 1.901929 0.663638
H 6.828402 1.980459 0.567497
H 7.866798 -0.348009 -0.224940


