%chk=000094295.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094295

0 1
 O   -6.565200      -1.274600     -0.2915000    
 O   -6.808900      0.8318000      0.2926000    
 N    6.057500      0.1439000     -2.5500000E-02
 N   -6.088200     -0.1515000     -2.0000001E-03
 C    4.656600     -1.7000001E-02 -2.7999999E-03
 C    1.885400     -0.3349000      4.2199999E-02
 C    3.830800      0.9885000     -0.5057000    
 C    4.096600      -1.181600      0.5226000    
 C    2.445200      0.8296000     -0.4831000    
 C    2.711000      -1.340500      0.5450000    
 C   0.4407000     -0.5007000      6.5600000E-02
 C   -1.925900      0.3344000     -1.7500000E-02
 C  -0.4623000      0.5047000     -2.1800000E-02
 C    6.646300       1.465100      6.7299999E-02
 C    6.927300      -1.011100     -0.1280000    
 C   -2.465600     -0.9011000     -0.3353000    
 C   -2.733400       1.413000      0.3053000    
 C   -4.677800      1.3300000E-02 -7.4000000E-03
 C   -3.851000      -1.062800     -0.3304000    
 C   -4.118900       1.251300      0.3104000    
 H    4.235700       1.899800     -0.9368000    
 H    4.710200      -1.978300      0.9334000    
 H    1.844900       1.628400     -0.9084000    
 H    2.292800      -2.253500      0.9622000    
 H   0.1101000      -1.529100      0.1821000    
 H  -0.1361000       1.539400     -8.5600004E-02
 H    6.607600       1.976100     -0.9004000    
 H    7.698700       1.408900      0.3677000    
 H    6.137200       2.079300      0.8186000    
 H    7.929100     -0.7223000     -0.4653000    
 H    6.547600      -1.736300     -0.8565000    
 H    7.036500      -1.502400      0.8446000    
 H   -1.862500      -1.759000     -0.6147000    
 H   -2.312900       2.383100      0.5567000    
 H   -4.251500      -2.040100     -0.5880000    
 H   -4.731400       2.111800      0.5673000    


%chk=000094295-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094295

0 1
O -6.738670 -1.362111 0.062182
O -6.983803 0.908813 -0.032486
N 6.168949 0.136649 -0.014061
N -6.251573 -0.160896 0.011451
C 4.781672 0.002864 -0.004175
C 1.897640 -0.264899 0.012034
C 3.921934 1.153084 -0.051177
C 4.155589 -1.285662 0.052149
C 2.529524 1.015545 -0.043135
C 2.759185 -1.402027 0.059394
C 0.452258 -0.461319 0.021035
C -1.967655 0.293724 -0.010155
C -0.522732 0.512051 -0.019203
C 6.784457 1.470214 -0.076429
C 7.024568 -1.057560 0.038152
C -2.575091 -1.002664 0.046623
C -2.836250 1.430233 -0.060026
C -4.790871 -0.003488 0.003548
C -3.967387 -1.155993 0.053651
C -4.232073 1.295070 -0.053733
H 4.351287 2.157786 -0.094468
H 4.762435 -2.194217 0.089329
H 1.917588 1.923682 -0.081062
H 2.312224 -2.403531 0.102753
H 0.134668 -1.513536 0.064452
H -0.213559 1.565525 -0.062838
H 6.490067 2.015327 -0.995568
H 7.880557 1.367445 -0.081197
H 6.505018 2.093360 0.796737
H 8.082011 -0.751820 0.022848
H 6.849798 -1.724931 -0.829454
H 6.852595 -1.644307 0.962731
H -1.947785 -1.898733 0.086089
H -2.394114 2.432518 -0.104452
H -4.438295 -2.141692 0.097039
H -4.897964 2.161095 -0.091680


