%chk=000146057.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146057

0 1
 O    1.416500       2.394100      0.3972000    
 O   -1.256900      -2.411600     -1.8300001E-02
 N   -5.012300      0.7073000      0.4504000    
 C    2.885800      0.1074000     -0.4821000    
 C    1.410400      5.5000000E-02 -0.1246000    
 C    3.758600     -0.8140000      0.3943000    
 C   -1.275000     -7.4699998E-02  0.5157000    
 C   -2.725700     -0.1265000      0.8661000    
 C   0.7642000       1.202100      0.2950000    
 C   0.7516000      -1.155400     -0.2335000    
 C   -3.617700      0.8011000      8.7000001E-03
 C  -0.6034000      -1.220700      8.9800000E-02
 C    3.093600     -0.2305000      -1.963500    
 C  -0.5912000       1.136800      0.6184000    
 C    3.631200     -0.5190000       1.883900    
 C   -3.559400      0.4503000      -1.478100    
 C    1.423100       3.230100     -0.7581000    
 C  -0.4932000      -3.531600     -0.4612000    
 H    3.274600       1.122400     -0.3390000    
 H    4.809800     -0.6886000      0.1051000    
 H    3.516300      -1.869500      0.2214000    
 H   -3.114300      -1.150800      0.8038000    
 H   -2.823100      0.1527000       1.924700    
 H   -3.304800       1.844300      0.1290000    
 H    1.318400      -2.015300     -0.5680000    
 H    2.482700      0.4146000      -2.604700    
 H    4.141800     -8.2300000E-02  -2.245900    
 H    2.836700      -1.269900      -2.194200    
 H   -1.101700       2.033900      0.9598000    
 H    4.342400      -1.131400       2.447700    
 H    3.850000      0.5324000       2.095700    
 H    2.629600     -0.7480000       2.259900    
 H   -4.242900       1.083000      -2.056100    
 H   -3.837200     -0.5949000      -1.655800    
 H   -2.555400      0.6072000      -1.885400    
 H   -5.069200      0.9182000       1.446200    
 H   -5.342900     -0.2517000      0.3471000    
 H   0.4101000       3.585400     -0.9725000    
 H    1.824100       2.702000      -1.628400    
 H    2.059500       4.094800     -0.5510000    
 H  -0.1224000      -3.390100      -1.482200    
 H   -1.170500      -4.391800     -0.4876000    
 H   0.3065000      -3.780700      0.2446000    


%chk=000146057-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146057

0 1
O 1.726711 2.414882 -0.001782
O -1.377942 -2.300068 0.116653
N -5.018313 0.862484 0.077883
C 3.044618 0.002829 -0.724656
C 1.568882 0.035766 -0.317685
C 3.891225 -0.917691 0.202523
C -1.216313 0.076307 0.427716
C -2.689324 0.126040 0.792236
C 0.922286 1.251652 0.035712
C 0.797739 -1.150051 -0.287040
C -3.614992 0.674084 -0.356527
C -0.569346 -1.139861 0.074803
C 3.201822 -0.418070 -2.210675
C -0.444941 1.261721 0.401645
C 3.899761 -0.467115 1.678679
C -3.594110 -0.239213 -1.596416
C 1.096660 3.683690 0.353865
C -0.740833 -3.576065 -0.199884
H 3.436486 1.030832 -0.619819
H 4.929623 -0.935527 -0.186478
H 3.516392 -1.959762 0.132222
H -3.045208 -0.882353 1.069854
H -2.828874 0.787185 1.672009
H -3.227292 1.671090 -0.650397
H 1.289585 -2.091698 -0.552470
H 2.631891 0.254653 -2.876277
H 4.265471 -0.384873 -2.513673
H 2.834724 -1.448703 -2.377510
H -0.937004 2.198234 0.686028
H 4.524549 -1.135988 2.299209
H 4.299725 0.559735 1.774330
H 2.877095 -0.467314 2.097692
H -4.226847 0.189744 -2.392433
H -3.978335 -1.246215 -1.342586
H -2.566151 -0.362621 -1.977263
H -5.120127 1.476547 0.894896
H -5.514394 -0.026128 0.218716
H 0.724271 3.674973 1.397665
H 0.261155 3.928950 -0.331662
H 1.890332 4.439315 0.252638
H -0.354122 -3.591631 -1.238278
H -1.534210 -4.331024 -0.091686
H 0.085974 -3.802641 0.502520


