%chk=000033192.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033192

0 1
 O   -1.247400       2.873800      3.5200000E-02
 O   -5.998500      -2.501300      0.4712000    
 O   -7.069500     -0.7936000     -0.4089000    
 O    6.266100      -2.346700     -0.4276000    
 O    7.264700     -0.4372000      1.3800000E-02
 N   -6.021100      -1.330200      2.2800000E-02
 N    6.228200      -1.122800     -0.1561000    
 C   -2.466900      0.8708000     -3.1800002E-02
 C    2.478300      0.7575000      0.1959000    
 C   -1.206300       1.651400     -5.1100001E-02
 C    1.182700       1.407000      0.3174000    
 C   -2.447400     -0.4191000      0.4603000    
 C   -3.623600       1.456600     -0.5065000    
 C    2.551000     -0.6026000     -0.1052000    
 C    3.648100       1.494400      0.3802000    
 C   -4.814100     -0.5827000      3.8000001E-03
 C   7.0900001E-02  0.8987000     -0.2074000    
 C    4.963400     -0.4887000     -3.7400000E-02
 C   -3.633200      -1.153500      0.4783000    
 C   -4.809400      0.7223000     -0.4885000    
 C    3.793600      -1.225600     -0.2218000    
 C    4.890600      0.8714000      0.2635000    
 H    1.164600       2.355100      0.8487000    
 H   -1.549900     -0.8838000      0.8567000    
 H   -3.634500       2.469800     -0.8975000    
 H    1.672800      -1.228500     -0.2317000    
 H    3.610600       2.555800      0.6141000    
 H   2.1700000E-02 -3.1900000E-02 -0.7589000    
 H   -3.600000      -2.165600      0.8737000    
 H   -5.709900       1.199100     -0.8672000    
 H    3.812100      -2.288100     -0.4515000    
 H    5.780500       1.477400      0.4135000    


%chk=000033192-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000033192

0 1
O -1.191721 2.713261 -0.012202
O -6.488041 -2.393622 0.155566
O -7.451464 -0.357652 -0.208474
O 6.710301 -2.218399 -0.037448
O 7.571780 -0.108624 0.098875
N -6.425359 -1.117024 -0.023351
N 6.582302 -0.935149 0.032017
C -2.539771 0.719408 -0.007198
C 2.593591 0.682703 0.040980
C -1.212212 1.439131 -0.002958
C 1.260277 1.293185 0.046387
C -2.674201 -0.683037 0.185000
C -3.708939 1.506783 -0.198367
C 2.809594 -0.726897 -0.035243
C 3.730884 1.541255 0.113213
C -5.080853 -0.478837 -0.016372
C 0.049570 0.651915 0.000864
C 5.207766 -0.374393 0.035366
C -3.944664 -1.290283 0.184703
C -4.984047 0.917702 -0.207749
C 4.107291 -1.260153 -0.038427
C 5.038286 1.024702 0.111296
H 1.219468 2.391627 0.090413
H -1.797777 -1.314802 0.353428
H -3.583309 2.585329 -0.334061
H 1.957121 -1.410577 -0.095138
H 3.578154 2.624716 0.170973
H -0.009014 -0.439552 -0.050035
H -4.071676 -2.365230 0.335776
H -5.892994 1.505833 -0.357064
H 4.290682 -2.336082 -0.096729
H 5.917175 1.671963 0.165959


