%chk=000010528.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010528

0 1
 O   0.5690000      0.3837000     -0.6167000    
 O  -0.7242000       1.170900      -2.350600    
 N   -1.592500       2.723400      0.8313000    
 C   -1.799500      0.4500000     -0.2609000    
 C   -1.582600       1.277500       1.047000    
 C   -3.094600      0.9243000      -1.001200    
 C   -1.805200      -1.055900      9.4899997E-02
 C  -0.6138000      0.7213000      -1.216200    
 C   -4.405100      0.6983000     -0.2492000    
 C   -1.938400      -1.955900     -0.9264000    
 C   -1.676200      -1.404800       1.411200    
 C   -1.508200       3.431800       2.108100    
 C  -0.4898000       3.117400     -4.5200001E-02
 C   -1.943400      -3.313500     -0.6059000    
 C   -1.681000      -2.762300       1.731700    
 C    1.743900      0.5861000      -1.407900    
 C   -1.814600      -3.716600      0.7231000    
 C    2.947100      0.1711000     -0.6131000    
 C    3.598500       1.103100      0.1872000    
 C    3.399500      -1.141900     -0.6835000    
 C    4.716800      0.7173000      0.9262000    
 C    4.517800      -1.527600      5.5599999E-02
 C    5.176400     -0.5978000      0.8604000    
 H  -0.6375000       1.009600       1.541000    
 H   -2.402600       1.067300       1.746100    
 H   -3.027000       1.988000      -1.261500    
 H   -3.181700      0.4025000      -1.963700    
 H   -4.557000     -0.3583000     -1.1100000E-02
 H   -4.438600       1.273300      0.6803000    
 H   -5.248100       1.023400     -0.8679000    
 H   -2.034400      -1.656800      -1.964500    
 H   -1.567600     -0.7386000       2.254900    
 H   -1.581800       4.514600       1.955800    
 H   -2.344400       3.156000       2.760500    
 H  -0.5724000       3.220000       2.638300    
 H  -0.3135000       4.197000      7.4000001E-02
 H   0.4697000       2.660500      0.2085000    
 H  -0.7483000       3.063200      -1.100500    
 H   -2.046000      -4.056700      -1.391200    
 H   -1.580500      -3.078100       2.766200    
 H    1.675600     -7.7999998E-03  -2.327900    
 H    1.824600       1.641800      -1.695400    
 H   -1.817900      -4.773600      0.9727000    
 H    3.247400       2.129500      0.2477000    
 H    2.892300      -1.874800      -1.305000    
 H    5.229200       1.440800       1.553500    
 H    4.875300      -2.551900      5.2999998E-03
 H    6.046900     -0.8983000       1.436200    


%chk=000010528-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000010528

0 1
O 0.686924 -0.727036 -0.033117
O 0.044639 0.283172 -2.029551
N -0.940819 2.126908 1.474499
C -1.560028 0.212862 -0.116372
C -1.344319 0.709106 1.351288
C -2.383739 1.259739 -0.932500
C -2.258244 -1.180882 -0.140052
C -0.211798 -0.028466 -0.841082
C -3.794384 1.518879 -0.368281
C -2.575221 -1.764852 -1.396869
C -2.587955 -1.905418 1.033190
C -1.194552 2.644362 2.835008
C 0.435374 2.418945 1.022866
C -3.215647 -3.019152 -1.478569
C -3.232075 -3.161827 0.954234
C 1.994746 -1.128870 -0.669848
C -3.552268 -3.725049 -0.300392
C 3.062753 -0.077098 -0.466717
C 3.230643 0.969748 -1.410170
C 3.912275 -0.126833 0.667790
C 4.227661 1.951180 -1.216993
C 4.910224 0.854132 0.862164
C 5.069586 1.896168 -0.081104
H -0.624128 0.024276 1.860071
H -2.316208 0.615964 1.869695
H -1.817947 2.207958 -0.935518
H -2.448085 0.924348 -1.982429
H -4.383081 0.586645 -0.288422
H -3.742203 1.989988 0.629270
H -4.345380 2.210467 -1.031530
H -2.311503 -1.237799 -2.320982
H -2.342853 -1.506464 2.021454
H -0.970498 3.725882 2.866111
H -2.259858 2.508856 3.096284
H -0.578836 2.144690 3.626041
H 0.643254 3.494005 1.169023
H 1.214492 1.831725 1.567593
H 0.546292 2.206073 -0.053664
H -3.450050 -3.445237 -2.460734
H -3.480688 -3.700221 1.876111
H 2.236511 -2.067890 -0.147650
H 1.802447 -1.315365 -1.740273
H -4.051508 -4.698606 -0.360300
H 2.568885 1.012410 -2.282594
H 3.790186 -0.935420 1.399244
H 4.350364 2.755342 -1.951091
H 5.563115 0.804763 1.740819
H 5.845105 2.656392 0.066252


