%chk=000165549.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165549

0 1
 O    3.331200      -1.820200      -1.009500    
 N   -2.567200      0.4751000      0.6032000    
 N    1.568500     -0.4087000     -0.3810000    
 C   -1.137300      0.1025000      0.5879000    
 C  -0.2471000       1.299200      0.1972000    
 C  -0.8462000      -1.119000     -0.3062000    
 C    1.253300      0.9418000      0.1057000    
 C   0.6252000      -1.507100     -0.2076000    
 C  -0.7221000       1.943500      -1.119200    
 C   -1.729300      -2.309700      9.7800002E-02
 C   -3.034900       1.073000     -0.6532000    
 C   -3.405500     -0.6617000       1.009100    
 C    2.008200       1.156900       1.422500    
 C   -2.202200       2.291500      -1.036300    
 C   -3.200900      -1.916200      0.1584000    
 C    3.508000      0.8559000       1.252500    
 C    2.920100     -0.7454000     -0.5762000    
 C    3.878100      0.3487000     -0.1452000    
 H  -0.8667000     -0.1622000       1.620800    
 H  -0.3651000       2.073500      0.9698000    
 H   -1.061300     -0.8755000      -1.354200    
 H    1.703500       1.637200     -0.6164000    
 H   0.8389000      -1.934600      0.7812000    
 H   0.8579000      -2.292000     -0.9377000    
 H  -0.5432000       1.273600      -1.968500    
 H  -0.1521000       2.859600      -1.316100    
 H   -1.422800      -2.684300       1.083200    
 H   -1.596800      -3.136400     -0.6099000    
 H   -4.076000       1.398500     -0.5378000    
 H   -3.017400      0.3555000      -1.481400    
 H   -4.464400     -0.3755000      0.9981000    
 H   -3.180000     -0.9010000       2.056600    
 H    1.598500      0.5059000       2.205100    
 H    1.881800       2.188300       1.772500    
 H   -2.351400       3.088600     -0.2969000    
 H   -2.543600       2.684800      -2.000600    
 H   -3.581100      -1.754800     -0.8570000    
 H   -3.782800      -2.743600      0.5807000    
 H    3.797600      0.1043000       1.997900    
 H    4.094600       1.753800       1.478800    
 H    4.897000     -5.3500000E-02 -0.1323000    
 H    3.856700       1.156200     -0.8851000    


%chk=000165549-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165549

0 1
O 3.317060 -1.989145 -0.724491
N -2.582127 0.452037 0.575437
N 1.587856 -0.473202 -0.287896
C -1.141781 0.056435 0.563065
C -0.242796 1.269298 0.206485
C -0.839126 -1.174676 -0.339410
C 1.275834 0.929226 0.123862
C 0.625762 -1.592535 -0.151225
C -0.727808 1.975148 -1.088125
C -1.768952 -2.358767 0.039121
C -3.061248 1.117140 -0.663577
C -3.434853 -0.694243 0.987469
C 2.070990 1.261385 1.418511
C -2.214982 2.364072 -0.970971
C -3.258214 -1.945222 0.083152
C 3.594448 0.969326 1.219955
C 2.932031 -0.807053 -0.454073
C 3.894012 0.349346 -0.181623
H -0.902499 -0.252655 1.606045
H -0.366367 2.000339 1.031706
H -1.009067 -0.905303 -1.401266
H 1.686692 1.585182 -0.671690
H 0.739431 -2.050096 0.857791
H 0.924431 -2.369031 -0.876836
H -0.576679 1.313456 -1.965397
H -0.109313 2.877275 -1.262852
H -1.471796 -2.729035 1.044165
H -1.616330 -3.200317 -0.664520
H -4.118201 1.401487 -0.499095
H -3.042128 0.447152 -1.560047
H -4.489324 -0.359858 0.995343
H -3.164847 -0.961740 2.029769
H 1.662268 0.667756 2.258096
H 1.906589 2.326807 1.667795
H -2.343679 3.098929 -0.152597
H -2.572277 2.833255 -1.907468
H -3.622863 -1.724317 -0.939266
H -3.875095 -2.779226 0.470690
H 3.951311 0.266540 1.994298
H 4.184636 1.896824 1.335957
H 4.918669 -0.052062 -0.230321
H 3.802034 1.126567 -0.965268


