%chk=000140851.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000140851

0 1
 O   -2.652900       1.370800       1.088100    
 N    3.363900     -0.1333000     -9.7300000E-02
 N   -3.077900     -0.4253000     -0.3466000    
 C    1.966000      1.6000001E-02  1.6500000E-02
 C  -0.7994000      0.3090000      0.2402000    
 C    1.277300      0.8377000     -0.8756000    
 C    1.272000     -0.6591000       1.020600    
 C  -0.1054000      0.9843000     -0.7639000    
 C  -0.1106000     -0.5126000       1.132400    
 C   -2.241100      0.4614000      0.3555000    
 C    4.176800      0.9454000     -0.6228000    
 C    4.007300      -1.362400      0.3228000    
 C   -4.529700     -0.3468000     -0.2691000    
 C   -2.546100      -1.485100      -1.200800    
 H    1.785400       1.367700      -1.676200    
 H    1.778800      -1.297200       1.738900    
 H  -0.6327000       1.624700      -1.466300    
 H  -0.6415000      -1.041600       1.919800    
 H    3.861600       1.916300     -0.2239000    
 H    5.229500      0.8184000     -0.3458000    
 H    4.125700      0.9727000      -1.716300    
 H    4.130400      -1.383900       1.410700    
 H    3.435600      -2.242900      8.1000002E-03
 H    5.003500      -1.459000     -0.1233000    
 H   -4.915000      -1.292000      0.1236000    
 H   -4.929000     -0.1728000      -1.272300    
 H   -4.844200      0.4683000      0.3876000    
 H   -1.458000      -1.520000      -1.244000    
 H   -2.927300      -1.333200      -2.215400    
 H   -2.908200      -2.446100     -0.8227000    


%chk=000140851-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000140851

0 1
O -2.717421 1.746010 0.068958
N 3.468746 -0.096015 -0.054459
N -3.150618 -0.517025 -0.275730
C 2.078172 0.038439 -0.072140
C -0.792422 0.304670 -0.138848
C 1.449924 1.188794 -0.653947
C 1.225776 -0.960137 0.501007
C 0.052908 1.314944 -0.668833
C -0.172873 -0.824128 0.459103
C -2.270638 0.563175 -0.115839
C 4.317152 0.965849 -0.610879
C 4.086747 -1.276571 0.561313
C -4.589569 -0.281977 -0.070935
C -2.804884 -1.811659 -0.883726
H 2.056173 1.990728 -1.084157
H 1.654408 -1.836977 0.994159
H -0.413530 2.215636 -1.082007
H -0.788800 -1.594891 0.936466
H 4.172127 1.930764 -0.083293
H 5.375808 0.679786 -0.509238
H 4.111986 1.132548 -1.687802
H 3.865414 -1.344458 1.646726
H 3.739277 -2.214928 0.083610
H 5.180216 -1.222595 0.441491
H -5.018138 -1.079003 0.566177
H -5.135813 -0.270656 -1.035968
H -4.717516 0.697888 0.412652
H -1.779397 -1.792401 -1.279739
H -3.497717 -2.020613 -1.723306
H -2.890697 -2.645799 -0.158319


