%chk=000064197.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064197

0 1
 O   -1.821200       2.181800     -0.6244000    
 N  -0.7643000      0.6738000      0.7832000    
 N   -5.387000      7.8699999E-02 -0.2771000    
 C    1.664300      0.6013000      0.4230000    
 C    2.972100      -1.550300      0.7142000    
 C    2.685900     -0.5597000      -1.585300    
 C    4.178100      0.5752000      9.8800004E-02
 C    1.776100     -0.7224000       1.216000    
 C    1.490700      0.2654000      -1.077200    
 C    2.978700       1.397400      0.6020000    
 C    2.779000      -1.865400     -0.7784000    
 C    4.263700     -0.7361000      0.8972000    
 C    3.978900      0.2495000      -1.390800    
 C   0.4734000       1.422200      0.9248000    
 C   -1.814000       1.129800      9.3999999E-03
 C   -3.019500      0.2618000     -1.1200000E-02
 C   -2.893400      -1.089000      0.2047000    
 C   -4.251200      0.8113000     -0.2450000    
 C   -4.039400      -1.875900      0.1795000    
 C   -5.251100      -1.249300     -6.3299999E-02
 H    3.040500      -2.484100       1.283500    
 H    2.550800     -0.7903000      -2.647900    
 H    5.101600       1.149900      0.2313000    
 H   0.8711000      -1.332000       1.109100    
 H    1.894300     -0.5153000       2.287500    
 H    1.403200       1.188300      -1.665100    
 H   0.5711000     -0.3071000      -1.250600    
 H    3.125500       1.654000       1.659100    
 H    2.925800       2.345900      5.2099999E-02
 H    3.616200      -2.472500      -1.144200    
 H    1.868400      -2.460100     -0.9214000    
 H    4.421600     -0.5177000       1.960600    
 H    5.127100      -1.323300      0.5613000    
 H    4.837300     -0.3202000      -1.767400    
 H    3.931800       1.177200      -1.974300    
 H   0.4026000       2.375300      0.3892000    
 H   0.5810000       1.651200       1.991300    
 H  -0.8831000     -0.1376000       1.379600    
 H   -1.939800      -1.581500      0.3632000    
 H   -4.396100       1.872700     -0.4156000    
 H   -3.985500      -2.947000      0.3372000    
 H   -6.174200      -1.818800     -9.5100001E-02


%chk=000064197-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000064197

0 1
O -1.691545 2.076869 -0.725681
N -0.818652 0.640455 0.893287
N -5.483627 0.198263 -0.441692
C 1.686607 0.529909 0.445485
C 3.135219 -1.560615 0.695684
C 2.747707 -0.557200 -1.602201
C 4.211489 0.653028 0.079805
C 1.888702 -0.801362 1.228546
C 1.504393 0.201677 -1.064207
C 2.964487 1.404087 0.617549
C 2.932700 -1.880144 -0.810688
C 4.395622 -0.670232 0.871225
C 4.009915 0.330901 -1.425999
C 0.476474 1.332056 0.997906
C -1.812479 1.052163 0.017341
C -3.069455 0.218690 0.009211
C -3.106294 -1.164317 0.319320
C -4.285340 0.844652 -0.376735
C -4.338482 -1.851004 0.251907
C -5.496096 -1.132872 -0.125815
H 3.262942 -2.503306 1.264119
H 2.600465 -0.784233 -2.676467
H 5.107690 1.291571 0.208479
H 0.992193 -1.447113 1.115922
H 2.010706 -0.585749 2.311171
H 1.349202 1.139339 -1.633771
H 0.593472 -0.413646 -1.205825
H 3.108095 1.655077 1.689596
H 2.835494 2.361999 0.073052
H 3.808352 -2.436972 -1.200512
H 2.045173 -2.531299 -0.946099
H 4.559795 -0.451134 1.945863
H 5.292940 -1.208703 0.506138
H 4.902472 -0.192939 -1.823329
H 3.895891 1.269906 -2.004048
H 0.367049 2.277614 0.436010
H 0.662948 1.583778 2.062189
H -1.013194 -0.125126 1.539394
H -2.190761 -1.711780 0.573986
H -4.278168 1.905110 -0.648893
H -4.402298 -2.920778 0.473735
H -6.470804 -1.629524 -0.191456


