%chk=000066859.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066859

0 1
 O   0.4305000       1.845600     -0.3747000    
 N  -0.5242000     -0.2612000      1.9099999E-02
 N   -5.108400      -1.783500      0.4146000    
 N    5.351900       1.022100      0.6812000    
 C   -1.913300      1.6600000E-02  1.1600000E-02
 C    1.873300      3.7200000E-02 -0.1312000    
 C   0.5443000      0.6269000     -0.1664000    
 C   -2.811200      -1.017000      0.2159000    
 C    2.969200      0.8085000      0.2559000    
 C   -2.341200       1.315800     -0.2014000    
 C    2.052000      -1.300100     -0.4856000    
 C   -4.178800     -0.7431000      0.2069000    
 C    4.243700      0.2426000      0.2888000    
 C   -3.708900       1.589800     -0.2103000    
 C   -4.627600      0.5604000     -6.0999999E-03
 C    3.326500      -1.866000     -0.4528000    
 C    4.422300      -1.094600     -6.5499999E-02
 H  -0.3096000      -1.233100      0.2244000    
 H   -2.459800      -2.032500      0.3816000    
 H    2.838000       1.850700      0.5389000    
 H   -1.695600       2.165000     -0.3665000    
 H    1.237100      -1.929400     -0.8309000    
 H   -4.059800       2.604300     -0.3761000    
 H   -5.690800      0.7867000     -1.5100000E-02
 H    3.467600      -2.904700     -0.7371000    
 H    5.410500      -1.546700     -4.5800000E-02
 H   -6.100100      -1.585400      0.4061000    
 H   -4.784000      -2.729100      0.5673000    
 H    5.223600       1.992000      0.9371000    
 H    6.276200      0.6123000      0.7039000    


%chk=000066859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066859

0 1
O 0.449463 1.932335 -0.217861
N -0.540551 -0.185521 0.033991
N -5.106679 -1.829942 0.386552
N 5.413570 1.014026 0.639478
C -1.931123 0.122595 0.009989
C 1.897651 -0.017835 -0.100712
C 0.552504 0.670410 -0.109594
C -2.824327 -0.962947 0.206531
C 3.010802 0.775065 0.252064
C -2.429664 1.435412 -0.202902
C 2.080424 -1.383216 -0.454388
C -4.228857 -0.759087 0.192296
C 4.321068 0.224412 0.283324
C -3.829261 1.622266 -0.217792
C -4.730318 0.557644 -0.025873
C 3.382059 -1.931961 -0.426609
C 4.493620 -1.150629 -0.056376
H -0.313884 -1.165702 0.215166
H -2.427117 -1.974685 0.370271
H 2.834455 1.830453 0.489894
H -1.734916 2.263340 -0.342584
H 1.246906 -2.001525 -0.806900
H -4.225056 2.631093 -0.382581
H -5.812527 0.733911 -0.041538
H 3.535442 -2.979481 -0.709762
H 5.496795 -1.594122 -0.040578
H -6.110869 -1.681568 0.376348
H -4.760665 -2.770759 0.546885
H 5.290918 1.996114 0.867750
H 6.353538 0.630004 0.653312


