%chk=000267988.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267988

0 1
O 1.955308 -0.510658 -0.317252
O 2.820767 -2.601312 0.312630
N 0.676253 -1.077392 -0.246140
N 4.096161 -0.973794 -0.794964
C -1.656074 -0.746013 -0.000246
C -0.113408 1.267554 0.116066
C -0.269376 -0.201926 -0.051050
C -2.690206 -0.060933 -0.659048
C -0.673642 1.905180 1.233095
C -1.930059 -1.932192 0.697597
C 0.593340 2.012414 -0.839666
C -3.992621 -0.561870 -0.612198
C -0.524417 3.285354 1.390488
C -3.237676 -2.424661 0.740932
C 0.731762 3.393589 -0.679108
C -4.268278 -1.741687 0.088570
C 0.174816 4.030348 0.434745
C 2.960414 -1.521798 -0.194335
C 5.416989 -1.532443 -0.429929
H -2.476045 0.857427 -1.205586
H -1.222137 1.323428 1.974209
H -1.121660 -2.472985 1.194900
H 1.035868 1.509836 -1.700053
H -4.795159 -0.033208 -1.124096
H -0.955156 3.781308 2.259152
H -3.449917 -3.346105 1.281612
H 1.275791 3.973928 -1.422558
H -5.285464 -2.128587 0.122943
H 0.285924 5.106396 0.558747
H 4.084433 0.006811 -1.070719
H 5.324922 -2.606909 -0.174038
H 5.874566 -1.015333 0.429268
H 6.091183 -1.453065 -1.300566


%chk=000267988-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267988

0 1
O 1.948524 -0.513340 -0.200544
O 2.819337 -2.741529 -0.462863
N 0.611395 -1.118183 -0.194339
N 4.179642 -0.832822 -0.224808
C -1.712366 -0.753899 0.047802
C -0.114248 1.286846 0.027351
C -0.329765 -0.192368 -0.050877
C -2.842922 0.038684 -0.291708
C -0.709060 2.029904 1.082281
C -1.915599 -2.102633 0.457500
C 0.669755 1.972299 -0.938918
C -4.144863 -0.503362 -0.221501
C -0.512664 3.424983 1.177543
C -3.216237 -2.638810 0.524864
C 0.848001 3.369347 -0.853583
C -4.337704 -1.842313 0.187693
C 0.263342 4.100363 0.207504
C 2.987700 -1.517953 -0.311787
C 5.471865 -1.517783 -0.308011
H -2.702111 1.072583 -0.623336
H -1.316500 1.510439 1.831415
H -1.043817 -2.712017 0.713882
H 1.127048 1.409203 -1.757942
H -5.006252 0.117904 -0.490762
H -0.967961 3.982691 2.003302
H -3.358733 -3.677074 0.844321
H 1.443137 3.888085 -1.613388
H -5.348624 -2.261209 0.244868
H 0.408645 5.184321 0.275306
H 4.135197 0.175279 -0.073029
H 5.278117 -2.589719 -0.471868
H 6.049300 -1.403061 0.628105
H 6.075626 -1.134154 -1.151072


