%chk=000093102.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093102

0 1
 O   0.4870000       2.128500      0.2562000    
 O  -0.5041000      -2.124700      0.2514000    
 O   -6.130800      -1.878200      -1.925300    
 O    6.136000       1.875200      -1.927000    
 N  -0.9086000      0.2118000      0.2555000    
 N   0.9137000     -0.2129000      0.2556000    
 N   -5.523500      -1.206800      0.2489000    
 N    5.528500       1.206000      0.2479000    
 C   0.2131000      0.9537000      0.2565000    
 C  -0.2303000     -0.9498000      0.2542000    
 C   -2.267500      0.5285000      0.2532000    
 C    2.250300     -0.5243000      0.2538000    
 C   -3.221200     -0.4894000      0.2523000    
 C    3.226300      0.4885000      0.2520000    
 C   -2.672200       1.863400      0.2514000    
 C    2.677500      -1.864400      0.2534000    
 C   -4.984200       1.162700      0.2480000    
 C    4.989400      -1.163400      0.2496000    
 C   -4.579700     -0.1723000      0.2497000    
 C    4.584700      0.1716000      0.2498000    
 C   -4.030600       2.180400      0.2489000    
 C    4.035800      -2.181300      0.2514000    
 C   -6.432900       1.526800      0.2452000    
 C    6.438200      -1.527500      0.2473000    
 C   -5.827100      -1.542400     -0.8393000    
 C    5.832100       1.540500     -0.8406000    
 H   -2.928700      -1.535500      0.2566000    
 H    2.935100       1.536000      0.2551000    
 H   -1.957500       2.680300      0.2515000    
 H    1.963600      -2.683200      0.2544000    
 H   -4.329400       3.225400      0.2461000    
 H    4.334700      -3.226200      0.2498000    
 H   -6.973800      0.9830000       1.027000    
 H   -6.581300       2.594300      0.4421000    
 H   -6.881100       1.303600     -0.7282000    
 H    6.886500      -1.305400     -0.7264000    
 H    6.979000     -0.9828000       1.028500    
 H    6.586500      -2.594800      0.4455000    


%chk=000093102-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093102

0 1
O 0.551573 2.189045 0.076422
O -0.549822 -2.189343 0.080875
O -7.327461 -2.850091 0.086000
O 7.329899 2.849143 0.084941
N -0.992684 0.249046 0.079163
N 0.994413 -0.249320 0.079560
N -5.661721 -1.081859 0.081976
N 5.663338 1.081691 0.082237
C 0.249631 0.992778 0.077676
C -0.247794 -0.993103 0.079724
C -2.361147 0.594655 0.079752
C 2.362841 -0.594911 0.080707
C -3.337163 -0.428056 0.083112
C 3.338873 0.427743 0.083699
C -2.745171 1.959228 0.076244
C 2.746932 -1.959422 0.078073
C -5.128906 1.290758 0.079335
C 5.130685 -1.290992 0.080964
C -4.708919 -0.076085 0.082221
C 4.710598 0.075836 0.083048
C -4.117595 2.279397 0.076846
C 4.119321 -2.279579 0.078995
C -6.600207 1.649037 0.075652
C 6.601972 -1.649239 0.077577
C -6.492235 -1.958130 0.078514
C 6.493800 1.958006 0.078056
H -3.044607 -1.481988 0.085178
H 3.046339 1.481690 0.085137
H -1.986043 2.746556 0.073848
H 1.987846 -2.746804 0.076064
H -4.414905 3.333849 0.074875
H 4.416534 -3.334065 0.077658
H -7.129847 1.197329 0.935358
H -6.741070 2.741486 0.124127
H -7.103932 1.281062 -0.838560
H 7.105782 -1.281616 -0.836728
H 7.131504 -1.197165 0.937160
H 6.742848 -2.741666 0.126514


