%chk=000128973.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128973

0 1
 O   -1.788700      0.9600000       1.404200    
 O    2.018400       2.552400     -9.5200002E-02
 O   -3.755100      -1.125100       1.280800    
 N  -0.2597000       1.117900     -0.7458000    
 N  -9.3800001E-02  -1.613300     -0.7143000    
 N    2.210900      -1.417200      3.6600001E-02
 N    3.265900      0.6734000      0.3403000    
 N    4.399800      -1.348300      0.7396000    
 C   -1.513200      0.4014000     -0.9158000    
 C   -1.264100      -1.045000      -1.371300    
 C   0.9143000      0.4839000     -0.4003000    
 C    1.015900     -0.8632000     -0.3576000    
 C   -2.239100      0.4358000      0.3939000    
 C    2.105700       1.328000     -4.2300001E-02
 C    3.289700     -0.6339000      0.3706000    
 C   -3.606400     -0.2096000      0.4822000    
 C   -4.700500      0.3030000     -0.4057000    
 H   -2.128600      0.9302000      -1.651500    
 H   -2.129600      -1.692700      -1.199900    
 H   -1.072000      -1.047600      -2.451300    
 H  -0.2717000       2.132000     -0.7117000    
 H   1.6300000E-02  -2.621600     -0.6947000    
 H    2.261200      -2.429300      6.4999998E-02
 H   -4.749300       1.392600     -0.3375000    
 H   -5.659400     -0.1082000     -7.8100003E-02
 H   -4.513500     -3.5000001E-03  -1.437300    
 H    5.259100     -0.8815000       1.008200    
 H    4.395100      -2.362300      0.7562000    


%chk=000128973-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128973

0 1
O -1.998640 -0.949732 0.702236
O 1.389168 2.549347 -0.756117
O -3.729754 1.350182 -1.406552
N -0.439667 0.592707 -1.491528
N 0.139545 -2.132782 -0.797771
N 2.121103 -1.333390 0.321332
N 2.756101 0.990299 0.375879
N 4.067462 -0.613095 1.466351
C -1.506105 -0.410401 -1.653574
C -0.847048 -1.805868 -1.857683
C 0.710329 0.260499 -0.789207
C 0.964407 -1.057762 -0.426847
C -2.311741 -0.306158 -0.352994
C 1.640476 1.350178 -0.406617
C 2.958615 -0.282816 0.707287
C -3.451062 0.716785 -0.344662
C -4.207648 0.885028 0.954416
H -2.133659 -0.132713 -2.515445
H -1.617334 -2.593647 -1.870942
H -0.333754 -1.806087 -2.835088
H -0.584218 1.587857 -1.692702
H -0.288682 -2.626270 -0.001838
H 2.395155 -2.311068 0.436343
H -4.639653 -0.079776 1.277917
H -5.002215 1.636490 0.834947
H -3.511119 1.188609 1.757718
H 4.676915 0.160778 1.721597
H 4.190624 -1.518893 1.910844


