%chk=000085192.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085192

0 1
 O   -2.496800     -0.2372000     -2.0500001E-02
 N   -7.327000     -0.5945000      5.0099999E-02
 C    2.420000     -0.3406000     -9.3199998E-02
 C    1.177900      0.5500000     -1.6600000E-02
 C    3.735000      0.4430000     -4.6999998E-02
 C  -0.1026000     -0.2833000     -4.3099999E-02
 C    4.976900     -0.4510000     -4.9199998E-02
 C   -1.345300      0.5951000     -8.9999996E-03
 C    6.256100      0.3789000      7.1000002E-02
 C   -3.694400      0.5277000      1.0200000E-02
 C    7.492200     -0.5055000      0.1079000    
 C   -4.885200     -0.4213000     -4.0000002E-03
 C   -6.206900      0.3386000      4.3499999E-02
 H    2.388500     -0.9320000      -1.016600    
 H    2.400900      -1.054100      0.7401000    
 H    1.181100       1.251800     -0.8593000    
 H    1.209800       1.147200      0.9026000    
 H    3.776900       1.126700     -0.9039000    
 H    3.743300       1.066800      0.8557000    
 H  -0.1223000     -0.9758000      0.8077000    
 H  -0.1290000     -0.9117000     -0.9422000    
 H    4.918900      -1.158100      0.7872000    
 H    5.002100      -1.042600     -0.9721000    
 H   -1.346000       1.209000      0.8993000    
 H   -1.361500       1.256800     -0.8830000    
 H    6.223200      0.9855000      0.9835000    
 H    6.331700       1.070400     -0.7762000    
 H   -3.713700       1.141100      0.9187000    
 H   -3.730600       1.188500     -0.8639000    
 H    7.462600      -1.185900      0.9649000    
 H    8.394700      0.1079000      0.1922000    
 H    7.572800      -1.104900     -0.8045000    
 H   -4.834600      -1.050600     -0.9021000    
 H   -4.807800      -1.109200      0.8481000    
 H   -6.293100       1.003900     -0.8226000    
 H   -6.253800      0.9576000      0.9458000    
 H   -8.201900     -7.2300002E-02  2.9500000E-02
 H   -7.310300      -1.157300     -0.7995000    


%chk=000085192-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085192

0 1
O -2.543761 -0.172373 -0.013508
N -7.414240 -0.702017 -0.073766
C 2.455147 -0.331172 -0.002316
C 1.205342 0.577317 0.023840
C 3.784016 0.457322 0.021682
C -0.118138 -0.220738 -0.006016
C 5.034570 -0.450240 -0.001971
C -1.352515 0.685268 0.026462
C 6.364098 0.338319 0.021644
C -3.792689 0.597453 0.018492
C 7.607906 -0.576402 -0.001629
C -4.955660 -0.398432 -0.022358
C -6.330909 0.300473 -0.037204
H 2.424032 -0.970224 -0.909328
H 2.422993 -1.022517 0.865403
H 1.241207 1.270895 -0.842499
H 1.236372 1.213155 0.933596
H 3.816271 1.147760 -0.847310
H 3.813749 1.098004 0.928094
H -0.164124 -0.912311 0.857457
H -0.162949 -0.847014 -0.918105
H 5.004331 -1.140490 0.867097
H 5.006551 -1.091446 -0.907935
H -1.361228 1.304505 0.953310
H -1.354319 1.378846 -0.846320
H 6.390791 0.978813 0.926990
H 6.393572 1.027692 -0.846949
H -3.835038 1.215366 0.945384
H -3.832949 1.290935 -0.853871
H 7.615951 -1.255442 0.871951
H 8.544863 0.010336 0.017658
H 7.620578 -1.204109 -0.912769
H -4.843969 -1.029881 -0.926646
H -4.901655 -1.071524 0.851595
H -6.356108 1.026898 -0.888975
H -6.447459 0.894276 0.890756
H -8.356295 -0.316103 0.039751
H -7.356536 -1.342600 -0.872188


