%chk=000025708.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025708

0 1
 O  -0.3328000      -1.024000     -0.4379000    
 O   -3.095000      -1.287400       1.867100    
 O   0.6494000      0.6451000      0.8937000    
 O   -3.759100      -2.377500     -0.5754000    
 O   0.2394000      -3.356200      -1.765600    
 O   -3.120600       3.015600       1.129400    
 O    3.467900       2.246400      -1.603000    
 O    1.270700       1.664000      -1.593000    
 N   -1.820200       1.530900     -0.1047000    
 C   -1.758600      0.4634000      0.8727000    
 C   -2.938500     -0.4978000      0.6860000    
 C   -2.732100      -1.394200     -0.5437000    
 C   -1.338400      -2.038700     -0.5476000    
 C  -0.4209000     -0.2904000      0.7838000    
 C   -1.062900      -2.805100      -1.838000    
 C   -2.499100       2.716600      0.1130000    
 C    1.918200      0.1346000      0.8450000    
 C   -2.381600       3.661400      -1.052800    
 C    2.807400      0.5347000     -0.1484000    
 C    2.307500     -0.7937000       1.806600    
 C    4.096200      2.0999999E-03 -0.1806000    
 C    3.596200      -1.326300       1.774400    
 C    4.490700     -0.9284000      0.7806000    
 C    2.416100       1.504800      -1.161600    
 H   -1.818000      0.9287000       1.865200    
 H   -3.876000      6.0800001E-02  0.5754000    
 H   -2.833900     -0.7749000      -1.444100    
 H   -1.228600      -2.734200      0.2951000    
 H  -0.3704000     -0.9957000       1.623400    
 H   -1.085900      -2.136400      -2.704300    
 H   -1.782200      -3.614100      -1.997300    
 H   -1.377500       1.375100      -1.006100    
 H   -3.818800      -1.915500       1.702400    
 H   -4.612000      -1.911300     -0.5997000    
 H   0.2581000      -3.973300      -1.014300    
 H   -3.008600       4.540500     -0.8808000    
 H   -1.341200       3.979500      -1.164300    
 H   -2.712400       3.166800      -1.970500    
 H    1.633900      -1.102100       2.600800    
 H    4.811700      0.2824000     -0.9493000    
 H    3.904800      -2.047800       2.525200    
 H    5.493400      -1.344700      0.7547000    
 H    3.195200       2.897100      -2.284700    


%chk=000025708-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000025708

0 1
O -0.503399 -1.268695 -0.272141
O -2.944226 -1.039665 2.202290
O 0.696160 0.468569 0.751207
O -4.088718 -2.239515 -0.012590
O -0.598057 -4.190124 -1.240902
O -3.602478 1.577830 -1.087483
O 3.608694 3.289939 -0.251622
O 1.341703 2.868160 -0.275053
N -1.497671 1.598574 -0.039384
C -1.652282 0.554244 0.989861
C -2.943146 -0.291221 0.927881
C -2.954969 -1.308482 -0.239129
C -1.678537 -2.173408 -0.230707
C -0.437547 -0.412974 0.907696
C -1.566821 -3.103388 -1.441543
C -2.418510 2.041426 -0.964353
C 1.994752 0.020724 0.537773
C -1.914167 3.169896 -1.863031
C 2.939765 1.032036 0.176437
C 2.399107 -1.324703 0.697105
C 4.307867 0.664040 0.044368
C 3.758780 -1.659903 0.544168
C 4.720060 -0.667311 0.231626
C 2.509649 2.420791 -0.116129
H -1.632680 1.026457 1.992534
H -3.828744 0.361089 0.850821
H -3.067650 -0.768836 -1.196093
H -1.661055 -2.760568 0.714322
H -0.359749 -1.029463 1.828210
H -1.178753 -2.535172 -2.302452
H -2.573451 -3.501345 -1.679184
H -0.546803 2.002175 -0.072420
H -3.651822 -1.732392 2.105411
H -4.912410 -1.829330 -0.377937
H -0.977057 -4.839365 -0.595607
H -2.039086 2.869715 -2.917574
H -2.544940 4.061767 -1.701343
H -0.859714 3.433455 -1.679301
H 1.656318 -2.099432 0.898345
H 5.028473 1.441571 -0.220787
H 4.067625 -2.704256 0.661933
H 5.774626 -0.936647 0.119243
H 3.262365 4.194540 -0.477669


