%chk=000056701.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056701

0 1
 O    1.316900       2.744200      0.5486000    
 O   -1.317400       2.743700     -0.5485000    
 N    2.657300      0.5989000     -0.7243000    
 N   -2.656800      0.5985000      0.7245000    
 N    1.281000      0.7196000     -0.6405000    
 N   -1.280500      0.7192000      0.6404000    
 C    4.602100     -0.8160000     -0.2584000    
 C   -4.602100     -0.8160000      0.2584000    
 C    5.082800      -2.107900      0.4035000    
 C   -5.083000      -2.107700     -0.4037000    
 C    3.091600     -0.6463000     -0.1057000    
 C   -3.091500     -0.6465000      0.1056000    
 C    6.580200      -2.301800      0.2254000    
 C   -6.580300      -2.301500     -0.2253000    
 C   0.7489000       1.810000      5.2000000E-03
 C  -0.7489000       1.809700     -5.2999998E-03
 H    5.120700      3.9600000E-02  0.1926000    
 H    4.868400     -0.8299000      -1.323000    
 H   -5.120600      3.9799999E-02 -0.1922000    
 H   -4.868200     -0.8302000       1.323000    
 H    4.556700      -2.966700     -2.9500000E-02
 H    4.846500      -2.088300       1.473700    
 H   -4.556900      -2.966700      2.8999999E-02
 H   -4.846800      -2.087900      -1.474000    
 H    2.582100      -1.501000     -0.5689000    
 H    2.832100     -0.6418000      0.9602000    
 H   -2.582200      -1.501300      0.5685000    
 H   -2.832300     -0.6417000     -0.9604000    
 H    7.139000      -1.474600      0.6744000    
 H    6.902100      -3.230400      0.7072000    
 H    6.845100      -2.360100     -0.8352000    
 H   -7.139100      -1.474100     -0.6741000    
 H   -6.902500      -3.229900     -0.7073000    
 H   -6.844900      -2.360000      0.8353000    
 H    2.894700      0.5915000      -1.715700    
 H   -2.893900      0.5907000       1.716100    
 H   0.7037000      7.8999996E-03  -1.078300    
 H  -0.7030000      7.6000001E-03   1.078100    


%chk=000056701-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000056701

0 1
O 0.615214 0.460740 1.697230
O -0.615144 0.461074 -1.696974
N 3.074110 0.374401 0.116495
N -3.074026 0.374510 -0.116232
N 1.755002 0.456592 -0.384099
N -1.754912 0.456549 0.384361
C 5.297620 -0.713036 0.097847
C -5.297558 -0.712889 -0.097882
C 6.189271 -1.818758 -0.512129
C -6.189269 -1.818676 0.511889
C 3.878463 -0.707200 -0.500706
C -3.878432 -0.707172 0.500749
C 7.605855 -1.843126 0.100883
C -7.605804 -1.842951 -0.101240
C 0.648593 0.457593 0.430657
C -0.648511 0.457624 -0.430402
H 5.218793 -0.848945 1.193232
H 5.779716 0.274170 -0.069519
H -5.218673 -0.848642 -1.193281
H -5.779638 0.274305 0.069599
H 6.261973 -1.672019 -1.609057
H 5.703329 -2.803736 -0.359884
H -6.262056 -1.672072 1.608829
H -5.703327 -2.803641 0.359559
H 3.943514 -0.609908 -1.613869
H 3.374775 -1.666813 -0.283637
H -3.943541 -0.610065 1.613925
H -3.374750 -1.666760 0.283548
H 7.561895 -2.019113 1.191906
H 8.224326 -2.642495 -0.346342
H 8.127080 -0.881020 -0.063033
H -7.561757 -2.018810 -1.192280
H -8.224324 -2.642362 0.345841
H -8.127028 -0.880856 0.062746
H 3.538750 1.294188 0.090541
H -3.538624 1.294312 -0.090132
H 1.558885 0.453908 -1.399857
H -1.558791 0.453699 1.400118


