%chk=000147801.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147801

0 1
 O    3.660600      0.7852000      9.0599999E-02
 O    5.436000     -0.6638000     -0.2321000    
 N   0.8816000       1.019600     -0.2764000    
 N    2.847600     -0.2998000     -0.1340000    
 C   -1.285000     -2.0199999E-02 -3.5700001E-02
 C   0.7038000      -1.360500      0.1088000    
 C   -2.725100      0.1180000     -7.7000000E-03
 C  -0.6826000      -1.259300      0.1407000    
 C    1.434000     -0.2017000     -0.1010000    
 C  -0.4686000       1.078900     -0.2390000    
 C    1.349600      -2.690900      0.2977000    
 C   -3.460500     -5.9000002E-03  -1.186600    
 C   -3.378100      0.3745000       1.198000    
 C   -4.848700      0.1271000      -1.159800    
 C   -4.766300      0.5072000       1.224600    
 C   -5.501600      0.3835000      4.5600001E-02
 C    4.980700      0.4469000      7.1999999E-03
 C    5.822600       1.661100      0.2590000    
 H   -1.292400      -2.145600      0.3019000    
 H  -0.8782000       2.074500     -0.3833000    
 H    1.851300      -3.006900     -0.6229000    
 H    2.078200      -2.656200       1.114600    
 H   0.6176000      -3.464400      0.5550000    
 H   -2.967300     -0.2059000      -2.134900    
 H   -2.820200      0.4737000       2.126100    
 H   -5.421400      3.0800000E-02  -2.077600    
 H   -5.275000      0.7069000       2.163200    
 H    3.262100      -1.107300     -0.5859000    
 H   -6.582600      0.4869000      6.6600002E-02
 H    5.628600       2.045000       1.263700    
 H    6.880000       1.390300      0.1878000    
 H    5.607600       2.424100     -0.4934000    


%chk=000147801-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000147801

0 1
O 3.693416 0.834892 0.240463
O 5.206564 -0.775581 -0.508763
N 0.988226 0.999620 0.154287
N 2.910547 -0.309408 0.709128
C -1.249248 -0.018894 0.156087
C 0.737440 -1.396006 0.674882
C -2.716520 0.132760 -0.029022
C -0.651415 -1.265509 0.502504
C 1.520051 -0.208814 0.472823
C -0.362662 1.078272 0.006435
C 1.389126 -2.710698 1.049134
C -3.242109 1.051898 -0.980154
C -3.636463 -0.635410 0.738624
C -4.634443 1.202592 -1.152061
C -5.028891 -0.490833 0.562221
C -5.536355 0.430743 -0.383282
C 4.906608 0.433422 -0.366653
C 5.712504 1.646088 -0.750659
H -1.280368 -2.156432 0.615064
H -0.748134 2.079351 -0.218912
H 2.100839 -3.058279 0.272312
H 1.956166 -2.622947 1.995868
H 0.633713 -3.503608 1.177202
H -2.555549 1.630723 -1.608236
H -3.259680 -1.327410 1.500802
H -5.015659 1.913147 -1.894126
H -5.718212 -1.088137 1.169695
H 3.404187 -1.180350 0.443974
H -6.617474 0.545102 -0.518812
H 6.644777 1.671032 -0.159388
H 5.993673 1.573766 -1.814817
H 5.143643 2.570710 -0.575817


