%chk=000006888.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006888

0 1
 O    1.259100     -2.3000000E-02 -0.5951000    
 O    2.470900     -0.7680000       1.207400    
 N  -0.9104000     -0.8330000     -0.1488000    
 N   -1.605900      -1.972100      8.7000001E-03
 N    3.154600       1.116800      3.7400000E-02
 C   0.4100000      -1.032600     -0.4087000    
 C   -1.559300      0.3970000     -3.9299998E-02
 C  -0.6791000      -2.919100     -0.1599000    
 C   0.5981000      -2.388700     -0.4231000    
 C   -1.093100       1.485000     -0.7658000    
 C   -2.662500      0.5178000      0.7957000    
 C   -1.057500      -4.338600     -6.1000001E-02
 C   -1.741300       2.715100     -0.6552000    
 C   -3.310900       1.747900      0.9061000    
 C    2.301300      3.4000002E-02  0.2886000    
 C   -2.850300       2.846600      0.1806000    
 C    4.317800       1.345100      0.8831000    
 C    2.958500       2.069900      -1.050900    
 H    1.522400      -2.919200     -0.6013000    
 H  -0.2822000       1.424300      -1.482300    
 H   -3.038100     -0.3165000       1.382200    
 H  -0.1939000      -4.993300     -0.2175000    
 H   -1.471400      -4.560800      0.9280000    
 H   -1.810700      -4.591700     -0.8143000    
 H   -1.392700       3.567100      -1.231800    
 H   -4.173300       1.851100       1.558300    
 H   -3.357000       3.803600      0.2642000    
 H    4.239000       2.341100       1.328300    
 H    5.218600       1.289800      0.2651000    
 H    4.389500      0.6031000       1.682200    
 H    3.875800       2.118000      -1.645100    
 H    2.753500       3.052900     -0.6172000    
 H    2.133200       1.792600      -1.708400    


%chk=000006888-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006888

0 1
O 1.313362 0.086504 0.118551
O 3.275376 -1.235764 0.321744
N -0.928026 -0.741993 0.144228
N -1.654591 -1.951402 0.183062
N 3.375317 1.053814 -0.201884
C 0.441570 -0.998759 0.215968
C -1.644958 0.490003 0.013970
C -0.706065 -2.925129 0.294077
C 0.621198 -2.381621 0.319562
C -1.111033 1.712122 0.494639
C -2.933565 0.459397 -0.576508
C -1.118625 -4.367777 0.381495
C -1.860191 2.901076 0.355624
C -3.671903 1.653534 -0.701860
C 2.736672 -0.127776 0.092317
C -3.139721 2.882205 -0.244270
C 4.848633 1.068497 -0.191792
C 2.702240 2.327330 -0.507281
H 1.566537 -2.905604 0.401200
H -0.136775 1.728409 0.987941
H -3.334187 -0.499669 -0.912939
H -0.676543 -4.961493 -0.439502
H -0.787797 -4.821876 1.333532
H -2.216429 -4.448448 0.320360
H -1.445727 3.842499 0.733800
H -4.666794 1.623531 -1.159761
H -3.717026 3.807445 -0.345489
H 5.219074 1.815437 0.535627
H 5.238352 1.326521 -1.194616
H 5.217114 0.071940 0.091912
H 3.151867 2.770149 -1.415629
H 2.823328 3.046331 0.326887
H 1.632015 2.162765 -0.684766


