%chk=000081660.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081660

0 1
 O    3.708200      -3.775800     -0.3193000    
 O    3.708200       3.775900      0.3193000    
 N   -2.095100      -1.384300     -0.1173000    
 N   -2.095000       1.384200      0.1172000    
 C  -0.9491000     -0.6823000     -5.7799999E-02
 C  -0.9491000      0.6822000      5.7900000E-02
 C   0.2527000      -1.480500     -0.1254000    
 C   0.2526000       1.480500      0.1254000    
 C   -3.251700     -0.7010000     -5.9500001E-02
 C   -3.251600      0.7009000      5.9400000E-02
 C   0.8347000      -1.969200       1.045600    
 C   0.8346000       1.969100      -1.045500    
 C   0.8348000      -1.765400      -1.361800    
 C   0.8348000       1.765400       1.361900    
 C   -4.468800      -1.376000     -0.1167000    
 C   -4.468600       1.376000      0.1167000    
 C    1.995500      -2.740000      0.9805000    
 C    1.995500       2.740000     -0.9805000    
 C    1.995500      -2.536400      -1.426900    
 C    1.995400       2.536400       1.426900    
 C    2.575900      -3.023600     -0.2557000    
 C    2.575800       3.023600      0.2558000    
 C   -5.681100     -0.6909000     -5.8699999E-02
 C   -5.681100      0.6910000      5.8699999E-02
 C    4.248500      -4.242000      0.9163000    
 C    4.248400       4.242000     -0.9163000    
 H   0.3938000      -1.757000       2.017000    
 H   0.3937000       1.756900      -2.016900    
 H   0.3951000      -1.393600      -2.284300    
 H   0.3951000       1.393600       2.284400    
 H   -4.483400      -2.460300     -0.2086000    
 H   -4.483100       2.460300      0.2086000    
 H    2.393400      -3.086200       1.928200    
 H    2.393400       3.086100      -1.928300    
 H    2.443100      -2.754100      -2.392800    
 H    2.443100       2.754000       2.392800    
 H   -6.618600      -1.236600     -0.1049000    
 H   -6.618500       1.236700      0.1050000    
 H    5.146000      -4.822300      0.6781000    
 H    3.556400      -4.919200       1.428100    
 H    4.565500      -3.411100       1.555800    
 H    3.556200       4.919300      -1.428100    
 H    4.565400       3.411200      -1.555800    
 H    5.145800       4.822400     -0.6782000    


%chk=000081660-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081660

0 1
O 3.779638 -4.139108 0.106828
O 3.779620 4.139092 -0.106803
N -1.977980 -1.341260 0.477240
N -1.977997 1.341227 -0.477298
C -0.813494 -0.711212 0.185451
C -0.813498 0.711181 -0.185550
C 0.403287 -1.568371 0.204367
C 0.403272 1.568353 -0.204426
C -3.168872 -0.662657 0.290308
C -3.168881 0.662624 -0.290322
C 0.481459 -2.650136 1.118391
C 0.481410 2.650192 -1.118370
C 1.463168 -1.403280 -0.733931
C 1.463183 1.403195 0.733824
C -4.411172 -1.296471 0.602526
C -4.411194 1.296432 -0.602506
C 1.586626 -3.525236 1.132909
C 1.586573 3.525295 -1.132856
C 2.562069 -2.275879 -0.743404
C 2.562083 2.275796 0.743327
C 2.634642 -3.336544 0.195990
C 2.634622 3.336534 -0.195987
C -5.614197 -0.647866 0.307000
C -5.614208 0.647824 -0.306942
C 3.900775 -5.258296 1.045232
C 3.900717 5.258362 -1.045114
H -0.347777 -2.801016 1.816496
H -0.347850 2.801117 -1.816436
H 1.420992 -0.596097 -1.471195
H 1.421039 0.595953 1.471024
H -4.384636 -2.295638 1.048623
H -4.384675 2.295599 -1.048606
H 1.617209 -4.339860 1.862633
H 1.617130 4.339975 -1.862518
H 3.373451 -2.160466 -1.468059
H 3.373490 2.160327 1.467946
H -6.568872 -1.133487 0.537151
H -6.568891 1.133443 -0.537064
H 4.856448 -5.740632 0.793384
H 3.072116 -5.981502 0.917947
H 3.926556 -4.903049 2.093663
H 3.072061 5.981555 -0.917734
H 3.926459 4.903206 -2.093577
H 4.856399 5.740678 -0.793261


