%chk=000164910.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164910

0 1
 O    1.622900     -0.9464000       1.720300    
 O    2.553300      -2.198200      7.3200002E-02
 N   -1.059200       2.300700      0.5547000    
 N    4.190000     -8.6000003E-02 -0.5523000    
 C   0.6058000       1.198100     -0.4143000    
 C    1.936300      0.8671000     -0.9639000    
 C  -0.5387000      0.3525000     -0.3996000    
 C   -1.569100       1.068200      0.2138000    
 C    2.898100      0.2130000      6.1200000E-02
 C   0.2546000       2.388400      0.1795000    
 C  -0.7976000     -0.9572000     -0.8504000    
 C   -2.850600      0.5376000      0.3996000    
 C   -3.083900     -0.7633000     -5.5500001E-02
 C   -2.074800      -1.501000     -0.6711000    
 C    2.350100      -1.103900      0.5838000    
 C   -4.437300      -1.369500      0.1210000    
 H    1.814300      0.2001000      -1.828200    
 H    2.401800       1.781500      -1.356300    
 H    3.066500      0.8858000      0.9108000    
 H   0.8201000       3.290000      0.3702000    
 H   -1.579900       3.034000       1.015700    
 H  -2.5300000E-02  -1.546200      -1.336400    
 H   -3.629400       1.119800      0.8818000    
 H   -2.267300      -2.512600      -1.020600    
 H    4.838400     -0.4222000      0.1591000    
 H    4.597600      0.7707000     -0.9250000    
 H   -4.476800      -1.932400       1.058800    
 H   -5.217300     -0.6006000      0.1412000    
 H   -4.676700      -2.046000     -0.7065000    
 H    1.281000      -1.802000       2.056800    


%chk=000164910-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000164910

0 1
O 1.722520 -0.960598 1.862745
O 2.493338 -2.146206 0.022228
N -1.132123 2.392637 0.473212
N 4.345482 -0.009365 -0.306276
C 0.637887 1.241720 -0.412469
C 2.025835 0.897382 -0.888076
C -0.523980 0.364366 -0.378705
C -1.617136 1.112949 0.180122
C 2.991197 0.259602 0.196888
C 0.222730 2.466226 0.113670
C -0.758972 -0.982047 -0.770006
C -2.908085 0.563515 0.352991
C -3.126207 -0.774409 -0.040195
C -2.043052 -1.528873 -0.599332
C 2.408068 -1.069026 0.658653
C -4.492399 -1.421676 0.120844
H 1.987411 0.194143 -1.742891
H 2.543543 1.809670 -1.243763
H 3.035078 0.942079 1.062682
H 0.790993 3.384461 0.254454
H -1.677546 3.152839 0.872273
H 0.045550 -1.590213 -1.198863
H -3.727041 1.154296 0.780753
H -2.230596 -2.566344 -0.902933
H 4.402025 -0.849614 -0.891227
H 4.817599 0.803663 -0.709808
H -4.442072 -2.309207 0.780044
H -5.225894 -0.721217 0.556852
H -4.892250 -1.764261 -0.852477
H 1.274996 -1.826493 2.070009


