%chk=000013785.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013785

0 1
 O   -1.185700     -1.1000000E-02   1.602400    
 N   -3.456100       1.000800      0.3791000    
 C   -3.353200     -0.1391000     -0.5428000    
 C   -4.608400       1.850300      4.7200002E-02
 C   -4.618200     -0.9980000     -0.5020000    
 C   -5.914400       1.056600      0.1071000    
 C   -5.861700     -0.1679000     -0.7996000    
 C   -2.221300       1.784700      0.3633000    
 C    1.446400      0.3378000      0.6114000    
 C   0.2878000       1.263500      0.1709000    
 C   -1.060500      0.9058000      0.7917000    
 C    1.242500      -1.125900      0.2346000    
 C    2.809700      0.8406000      0.1472000    
 C    1.793500      -2.101100       1.038000    
 C    3.919100      0.5521000      0.9126000    
 C   0.5138000      -1.425000     -0.8966000    
 C    2.886600       1.566000      -1.022200    
 C    1.607000      -3.439900      0.6936000    
 C    5.165800       1.011600      0.4883000    
 C   0.3271000      -2.763800      -1.240700    
 C    4.133500       2.025300      -1.446600    
 C   0.8737000      -3.771200     -0.4456000    
 C    5.273000       1.748100     -0.6913000    
 H   -2.522500     -0.8053000     -0.2923000    
 H   -3.183400      0.2090000      -1.570800    
 H   -4.493000       2.293400     -0.9509000    
 H   -4.678300       2.677200      0.7643000    
 H   -4.715800      -1.462200      0.4877000    
 H   -4.536500      -1.812700      -1.230500    
 H   -6.751800       1.698900     -0.1878000    
 H   -6.103700      0.7383000       1.140200    
 H   -5.845100      0.1535000      -1.848300    
 H   -6.762200     -0.7766000     -0.6631000    
 H   -2.271600       2.617600       1.073600    
 H   -2.025200       2.190700     -0.6361000    
 H    1.445000      0.3891000       1.711900    
 H   0.5078000       2.290100      0.4942000    
 H   0.1419000       1.292400     -0.9130000    
 H    2.353900      -1.859800       1.935200    
 H    3.850200     -7.4000000E-03   1.839700    
 H   9.2100002E-02 -0.6772000      -1.556700    
 H    2.033000       1.785800      -1.651400    
 H    2.029900      -4.224400       1.314200    
 H    6.052800      0.7984000       1.077700    
 H  -0.2396000      -3.022300      -2.130500    
 H    4.218600       2.594600      -2.367700    
 H   0.7287000      -4.813600     -0.7139000    
 H    6.243900       2.105200      -1.022100    


%chk=000013785-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013785

0 1
O -1.146084 0.508636 1.725064
N -3.512693 0.863575 0.083122
C -3.791640 -0.542084 0.483472
C -4.557224 1.395848 -0.829599
C -5.162769 -0.653700 1.178357
C -5.947937 1.342721 -0.165887
C -6.288188 -0.099011 0.275930
C -2.164697 1.054867 -0.453008
C 1.501225 0.364696 0.469725
C 0.367797 1.319065 -0.006204
C -1.008930 0.915667 0.542783
C 1.345615 -1.013028 -0.200461
C 2.907435 0.944877 0.273299
C 0.672311 -2.063551 0.474284
C 3.986459 0.373162 0.998701
C 1.829873 -1.248024 -1.513635
C 3.190231 2.010565 -0.617745
C 0.484332 -3.318928 -0.148652
C 5.304288 0.851532 0.844074
C 1.640863 -2.500316 -2.138781
C 4.510365 2.494173 -0.777285
C 0.966363 -3.541662 -1.458628
C 5.573005 1.917242 -0.047994
H -2.993334 -0.867872 1.168961
H -3.776303 -1.215610 -0.415903
H -4.590866 0.815596 -1.791458
H -4.300243 2.442156 -1.084129
H -5.126057 -0.079673 2.123900
H -5.354906 -1.713092 1.436022
H -6.707271 1.726579 -0.874459
H -5.943570 2.008355 0.718704
H -6.391526 -0.743970 -0.621830
H -7.259852 -0.122578 0.804738
H -2.087213 2.071375 -0.892198
H -1.913499 0.351451 -1.299068
H 1.337617 0.223575 1.556161
H 0.570066 2.342701 0.373991
H 0.330578 1.378616 -1.110194
H 0.291559 -1.891529 1.488085
H 3.785886 -0.457233 1.687091
H 2.377118 -0.455330 -2.037835
H 2.382448 2.476735 -1.192559
H -0.034767 -4.120614 0.389081
H 6.120285 0.397459 1.417729
H 2.026323 -2.668080 -3.151170
H 4.706496 3.320785 -1.469936
H 0.824720 -4.515234 -1.941439
H 6.595413 2.292110 -0.169618


