%chk=000117585.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117585

0 1
 O    1.679200      7.0000000E-02 -0.3164000    
 O   -1.683800      7.7000000E-02  0.3170000    
 O    3.050800     -0.7986000       1.308200    
 O   -3.018900     -0.8332000      -1.315100    
 N    3.136000      -1.552900     -0.8840000    
 N   -3.151900      -1.532700      0.8928000    
 C   5.0000002E-04   1.836200     -2.7999999E-03
 C   0.5998000       2.708600      -1.146200    
 C  -0.6132000       2.695400       1.142700    
 C    1.096000      0.9432000      0.6425000    
 C   -1.079900      0.9266000     -0.6502000    
 C    1.721600       3.656700     -0.7397000    
 C   -1.750600       3.625800      0.7388000    
 C    2.662100     -0.7670000      0.1452000    
 C   -2.655800     -0.7722000     -0.1451000    
 C    4.177900      -2.540900     -0.7245000    
 C   -4.189700      -2.525400      0.7350000    
 C    4.674100      -2.598000      0.7055000    
 C   -4.654200      -2.618600     -0.7037000    
 H   0.9879000       2.054000      -1.937800    
 H  -0.1954000       3.298300      -1.618400    
 H   0.1722000       3.297000       1.616200    
 H  -0.9900000       2.033600       1.933600    
 H    1.879700       1.561400       1.096000    
 H   0.6565000      0.3352000       1.443900    
 H  -0.6279000      0.3032000      -1.432300    
 H   -1.855800       1.536200      -1.128800    
 H    2.591800       3.116900     -0.3570000    
 H    1.392100       4.374800      1.5799999E-02
 H    2.053100       4.229600      -1.612400    
 H   -2.609600       3.072400      0.3497000    
 H   -1.431700       4.353900     -1.1700000E-02
 H   -2.095000       4.187500       1.613700    
 H    2.729500      -1.430100      -1.806400    
 H   -2.766000      -1.386600       1.820500    
 H    4.989900      -2.278500      -1.409500    
 H    3.767600      -3.506900      -1.034300    
 H   -5.016700      -2.246800       1.395300    
 H   -3.785900      -3.482900       1.077900    
 H    5.459700      -3.362000      0.7636000    
 H    3.902500      -2.921500       1.411800    
 H    5.151100      -1.666800       1.028600    
 H   -5.438000      -3.384500     -0.7600000    
 H   -3.867100      -2.958900      -1.384500    
 H   -5.124300      -1.696300      -1.060200    


%chk=000117585-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117585

0 1
O 1.784752 0.060823 0.026747
O -1.718576 0.000491 -0.073698
O 2.570416 -1.055429 1.953572
O -2.751048 -0.886142 -2.003315
N 3.321521 -1.593605 -0.213888
N -3.288051 -1.621794 0.170152
C 0.002919 1.747887 -0.032356
C 0.886756 2.623585 -0.979354
C -0.901473 2.610162 0.907550
C 0.878980 0.865585 0.885861
C -0.853461 0.838550 -0.942388
C 1.827570 3.625736 -0.275432
C -1.857660 3.592617 0.196674
C 2.572338 -0.892939 0.705305
C -2.612509 -0.854388 -0.752505
C 4.277342 -2.639522 0.178656
C -4.316715 -2.599525 -0.213804
C 5.739663 -2.260186 -0.135670
C -5.693551 -2.284262 0.405827
H 1.495524 1.944740 -1.606562
H 0.221952 3.176930 -1.671721
H -0.250269 3.178405 1.600826
H -1.499590 1.921884 1.534802
H 1.491253 1.475778 1.573960
H 0.255862 0.179571 1.485078
H -0.211971 0.173722 -1.547073
H -1.492947 1.425580 -1.625102
H 2.551547 3.112435 0.382617
H 1.271106 4.359527 0.335328
H 2.409240 4.191769 -1.025809
H -2.570838 3.065073 -0.461889
H -1.311928 4.333551 -0.415107
H -2.451413 4.151257 0.943099
H 3.213625 -1.342729 -1.197423
H -3.054923 -1.486629 1.154813
H 4.013268 -3.587946 -0.329406
H 4.143727 -2.793917 1.262751
H -3.991474 -3.616629 0.083300
H -4.371912 -2.578237 -1.315357
H 6.420029 -3.074872 0.173294
H 6.028500 -1.341751 0.404241
H 5.889223 -2.087511 -1.217944
H -6.433798 -3.044679 0.096660
H -6.052932 -1.293739 0.076777
H -5.649875 -2.287025 1.511212


