%chk=000036584.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036584

0 1
 O   -3.493400       1.053000      1.1000000E-03
 N    1.110900       1.757900      6.0000003E-04
 N   0.2801000     -0.4351000     -3.0000000E-03
 N   -1.212900       1.443300      6.0000003E-04
 N  -0.6095000      -2.604900     -6.0000001E-03
 N   -2.093300     -0.7889000     -2.9000000E-03
 C    2.491200       1.306900      8.9999998E-04
 C    3.410600       2.531500      4.1999999E-03
 C    2.726100      0.4633000       1.256100    
 C    2.736800      0.4685000      -1.256700    
 C   2.9700000E-02  0.8984000     -5.0000002E-04
 C  -0.8176000      -1.208400     -4.0000002E-03
 C   0.6926000      -3.194600     -6.8999999E-03
 C   -2.214100      0.5485000     -5.0000002E-04
 C   0.5809000      -4.707000      1.3300000E-02
 C   -3.618300       2.467700      3.7000000E-03
 H    3.234000       3.156200      0.8876000    
 H    4.466500       2.239200      5.7999999E-03
 H    3.237100       3.159000     -0.8779000    
 H    2.272000     -0.5296000       1.229100    
 H    2.358600      0.9739000       2.154300    
 H    3.800200      0.2914000       1.399500    
 H    2.274600     -0.5210000      -1.240700    
 H    2.382000      0.9868000      -2.155600    
 H    3.811300      0.2906000      -1.388600    
 H   0.9092000       2.751200      2.6000000E-03
 H   -1.440200      -3.185600     -8.5000005E-03
 H    1.249500      -2.891000     -0.9006000    
 H    1.260800      -2.870500      0.8724000    
 H   4.7100000E-02  -5.050600      0.9059000    
 H   3.6699999E-02  -5.073400     -0.8638000    
 H    1.575600      -5.163600      1.3300000E-02
 H   -3.174700       2.904200     -0.8976000    
 H   -3.173800       2.901000      0.9061000    
 H   -4.684800       2.711900      4.6999999E-03


%chk=000036584-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036584

0 1
O -3.501611 1.022435 -0.001536
N 1.129931 1.677371 0.002980
N 0.296831 -0.551245 -0.000910
N -1.175568 1.399032 0.001532
N -0.713557 -2.675803 -0.004722
N -2.141774 -0.833781 -0.003238
C 2.592476 1.374385 0.002664
C 3.307961 2.748600 0.003909
C 2.979242 0.578053 1.276809
C 2.978969 0.580330 -1.272976
C 0.076596 0.800794 0.001943
C -0.848592 -1.313632 -0.003053
C 0.578051 -3.378332 -0.006032
C -2.214555 0.522248 -0.001053
C 0.356549 -4.899928 0.010334
C -3.641803 2.492053 0.000705
H 3.044669 3.335293 0.904382
H 4.401567 2.602483 0.002941
H 3.043426 3.337464 -0.894782
H 2.438145 -0.381507 1.300133
H 2.724564 1.151464 2.186611
H 4.066461 0.378673 1.281452
H 2.436580 -0.378445 -1.298621
H 2.725732 1.156123 -2.181666
H 4.065902 0.379348 -1.277384
H 0.843070 2.658727 0.003970
H -1.586829 -3.205226 -0.008155
H 1.161422 -3.080688 -0.899134
H 1.171188 -3.062611 0.874000
H -0.197101 -5.214467 0.914175
H -0.209280 -5.232309 -0.879584
H 1.327291 -5.424774 0.008648
H -3.171840 2.931346 -0.895670
H -3.173670 2.928435 0.899457
H -4.728942 2.658293 -0.000130


