%chk=000126571.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126571

0 1
 O    3.055300       1.861700      0.6484000    
 N   -2.128700      0.6402000      0.6019000    
 C   -1.660900      0.5446000     -0.8047000    
 C  -0.8183000     -0.7454000      -1.050600    
 C   -1.642000      -1.972400     -0.6170000    
 C  -0.8052000       1.743000      -1.252000    
 C   0.5919000     -0.6544000     -0.4646000    
 C   -2.120800      -1.834100      0.8204000    
 C   -2.910500     -0.5421000      0.9966000    
 C   0.4405000       1.896500     -0.3859000    
 C    1.178500      0.5979000     -0.1805000    
 C   -2.932400       1.843100      0.8437000    
 C    1.373900      -1.808500     -0.2776000    
 C    2.482500      0.6606000      0.3418000    
 C    2.672200      -1.732400      0.2314000    
 C    3.224100     -0.4984000      0.5489000    
 H   -2.541400      0.5009000      -1.462300    
 H  -0.6672000     -0.8375000      -2.136600    
 H   -1.098100      -2.912700     -0.7432000    
 H   -2.520800      -2.051300      -1.271700    
 H   -1.380400       2.675300      -1.249200    
 H  -0.5010000       1.590200      -2.296900    
 H   -2.756100      -2.688800       1.079500    
 H   -1.268200      -1.851000       1.509900    
 H   -3.841700     -0.6005000      0.4170000    
 H   -3.192800     -0.4635000       2.053800    
 H   0.1671000       2.300700      0.5962000    
 H    1.098100       2.628500     -0.8707000    
 H   -3.794800       1.903900      0.1702000    
 H   -2.336300       2.753700      0.7339000    
 H   -3.303300       1.858900       1.875400    
 H   0.9933000      -2.792800     -0.5327000    
 H    3.251500      -2.640000      0.3743000    
 H    4.234200     -0.4533000      0.9465000    
 H    3.952100       1.709900      0.9925000    


%chk=000126571-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126571

0 1
O 2.994855 1.914563 0.669357
N -2.130692 0.641409 0.563682
C -1.667809 0.534852 -0.851110
C -0.828713 -0.757995 -1.080866
C -1.643422 -1.996470 -0.622791
C -0.812140 1.750473 -1.268180
C 0.585020 -0.664408 -0.475725
C -2.087836 -1.842830 0.844454
C -2.902793 -0.548876 1.003233
C 0.410688 1.906510 -0.344817
C 1.160046 0.598496 -0.161056
C -2.895727 1.877529 0.832162
C 1.359486 -1.841644 -0.289411
C 2.480954 0.633549 0.357546
C 2.673291 -1.781751 0.216317
C 3.246698 -0.536135 0.549585
H -2.557246 0.472255 -1.537395
H -0.701609 -0.836859 -2.183085
H -1.075603 -2.932245 -0.769103
H -2.543092 -2.073936 -1.268391
H -1.406870 2.681827 -1.277079
H -0.478004 1.581234 -2.310894
H -2.703961 -2.707251 1.158171
H -1.201667 -1.799834 1.504395
H -3.859148 -0.647543 0.419340
H -3.182491 -0.401099 2.063539
H 0.085062 2.264690 0.651904
H 1.100797 2.676946 -0.734775
H -3.796829 1.988087 0.175149
H -2.263928 2.771449 0.700258
H -3.240755 1.866227 1.881493
H 0.937105 -2.819114 -0.542005
H 3.252847 -2.701481 0.351870
H 4.268355 -0.478104 0.947786
H 3.919430 1.837980 1.012541


