%chk=000231676.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231676

0 1
O 1.457723 2.977782 -0.071856
N 1.872337 0.174229 -0.275457
N -1.837114 0.138217 -0.105190
N -0.659113 2.797740 0.691492
C 0.557593 0.698839 0.206356
C -0.507235 0.157664 -0.787029
C 3.057386 0.774300 0.418517
C -2.961259 -0.031327 -1.082063
C 0.530192 2.241360 0.214823
C 4.249942 -0.137050 0.280813
C -4.213077 -0.463806 -0.357907
C 4.907891 -0.620391 1.420826
C 4.715712 -0.494268 -0.994250
C -4.852562 -1.660910 -0.709689
C -4.747444 0.337025 0.662718
C 6.023590 -1.452053 1.284486
C 5.827937 -1.328594 -1.125061
C -6.020647 -2.049839 -0.047111
C -5.912775 -0.057954 1.324198
C 6.484326 -1.808584 0.013635
C -6.552002 -1.250776 0.969786
H 0.322076 0.359691 1.252127
H -0.546836 0.819921 -1.681286
H -0.201687 -0.840109 -1.172800
H 1.883966 -0.846301 -0.141349
H 2.860283 1.024821 1.482776
H 3.263616 1.757243 -0.088481
H -1.863039 -0.624905 0.583402
H -3.132739 0.958807 -1.568926
H -2.717455 -0.739700 -1.905410
H 4.557846 -0.346091 2.413642
H 4.201547 -0.115011 -1.878590
H -4.446204 -2.290136 -1.499105
H -4.246966 1.264156 0.939657
H -0.777920 3.798717 0.636403
H -1.513058 2.253360 0.752758
H 6.534632 -1.821611 2.171574
H 6.186657 -1.602747 -2.115590
H -6.516922 -2.978579 -0.324629
H -6.324739 0.565239 2.116572
H 7.352551 -2.455517 -0.090095
H -7.461209 -1.555754 1.484414


%chk=000231676-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231676

0 1
O 1.431792 2.742869 0.377564
N 1.914194 -0.044670 0.046727
N -1.852127 -0.170133 -0.022277
N -0.871412 2.394216 0.389833
C 0.564026 0.399910 0.422071
C -0.457564 -0.291897 -0.525393
C 3.009183 0.259291 1.003653
C -2.884815 -0.658364 -0.981423
C 0.436353 1.958145 0.379304
C 4.348532 -0.222285 0.466174
C -4.282234 -0.562526 -0.386062
C 5.241069 -0.958004 1.284472
C 4.735230 0.085615 -0.864726
C -5.089108 -1.718397 -0.246392
C -4.800804 0.689217 0.036493
C 6.500417 -1.372440 0.790816
C 5.989684 -0.330393 -1.361004
C -6.389168 -1.629695 0.304433
C -6.096417 0.781508 0.589082
C 6.878484 -1.060088 -0.534807
C -6.895394 -0.379183 0.724622
H 0.296739 0.106138 1.476246
H -0.406521 0.181003 -1.523281
H -0.155536 -1.359320 -0.652722
H 1.920048 -1.040211 -0.214874
H 2.828306 -0.191887 2.011521
H 3.021091 1.356516 1.129679
H -1.961240 -0.634236 0.892777
H -2.806152 -0.026999 -1.888761
H -2.688091 -1.707368 -1.303358
H 4.950990 -1.205351 2.313645
H 4.038482 0.650644 -1.492969
H -4.699942 -2.691543 -0.570923
H -4.184755 1.589798 -0.071069
H -1.047331 3.398822 0.396556
H -1.623229 1.676637 0.309528
H 7.181171 -1.939045 1.436752
H 6.278926 -0.082591 -2.389064
H -7.002394 -2.532081 0.405380
H -6.485819 1.754326 0.909563
H 7.852973 -1.381123 -0.920502
H -7.901836 -0.307727 1.151817


