%chk=000003182.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003182

0 1
 O   -3.317900       1.108900     -0.9195000    
 O  -0.2314000      -2.126700      0.5916000    
 O   -5.131100      -1.001500      -1.014500    
 O    4.099900     -0.7497000     -0.5735000    
 N  -0.9107000      0.7864000      0.6303000    
 N    2.481600      0.8879000     -0.2366000    
 N    1.945100      -1.461400      7.1000000E-03
 N   0.5745000       2.386800      0.1800000    
 C   0.2665000      0.1499000      0.3595000    
 C   -2.175100      0.1844000      0.9799000    
 C    1.157800       1.151700      8.7600000E-02
 C   -3.034700     -0.1204000     -0.2485000    
 C   0.5827000      -1.241600      0.3429000    
 C  -0.6749000       2.131600      0.5094000    
 C    2.933100     -0.4545000     -0.2905000    
 C   -4.356800     -0.7650000      0.1563000    
 C    3.400500       1.983500     -0.5195000    
 C    2.390900      -2.850100     -4.1999999E-02
 H   -1.985500     -0.7127000       1.576500    
 H   -2.689500      0.9006000       1.633600    
 H   -2.497900     -0.7592000     -0.9593000    
 H   -1.445000       2.873300      0.6727000    
 H   -4.935100     -9.8800004E-02  0.8051000    
 H   -4.190800      -1.718200      0.6675000    
 H    4.402800       1.618600     -0.7573000    
 H    3.460600       2.632300      0.3598000    
 H    3.020800       2.553700      -1.372800    
 H    1.594300      -3.560100      0.1912000    
 H    3.210100      -2.978900      0.6725000    
 H    2.777100      -3.057500      -1.045000    
 H   -3.880400      0.8994000      -1.684700    
 H   -5.964900      -1.410700     -0.7264000    


%chk=000003182-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003182

0 1
O -3.725557 1.513523 -0.203170
O 0.004637 -2.335067 0.745722
O -5.490206 -0.381071 -0.976057
O 4.295931 -0.715129 -0.357684
N -0.937106 0.632579 0.430417
N 2.546518 0.848659 -0.284557
N 2.150978 -1.488303 0.190964
N 0.534701 2.288802 -0.140089
C 0.323525 0.025952 0.288674
C -2.190572 -0.054394 0.806504
C 1.196041 1.070251 -0.059516
C -3.282706 0.112404 -0.255213
C 0.742825 -1.342109 0.437891
C -0.756463 1.981189 0.164587
C 3.073594 -0.457636 -0.163920
C -4.479912 -0.812953 0.007879
C 3.436499 1.968402 -0.649844
C 2.735997 -2.843864 0.309359
H -1.937716 -1.120046 0.946658
H -2.560147 0.361286 1.761724
H -2.873018 -0.117175 -1.261521
H -1.586316 2.681790 0.178573
H -4.853716 -0.673730 1.043802
H -4.191559 -1.871557 -0.149443
H 4.448909 1.559961 -0.780568
H 3.430514 2.730122 0.147473
H 3.088117 2.436712 -1.585411
H 1.919857 -3.529893 0.578560
H 3.519770 -2.850427 1.084292
H 3.194901 -3.142174 -0.647254
H -4.558867 1.564660 -0.743524
H -6.342855 -0.858765 -0.831910


