%chk=000087745.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087745

0 1
 O   -3.052000     -0.4754000     -0.1576000    
 O    3.050300     -0.4687000      0.1628000    
 N   -5.747500       1.671800       1.060500    
 N    5.753100       1.656100      -1.078500    
 C  -0.7020000     -0.4566000      0.3017000    
 C   0.7004000     -0.4465000     -0.2966000    
 C   -1.773900     -0.4822000     -0.7785000    
 C    1.772400     -0.4642000      0.7836000    
 C   -4.099200     -0.4986000      -1.118200    
 C    4.097700     -0.4851000       1.123500    
 C   -5.445300     -0.4904000     -0.4073000    
 C    5.443600     -0.4892000      0.4124000    
 C   -5.613200      0.7186000      0.4127000    
 C    5.615600      0.7103000     -0.4206000    
 H  -0.8484000      0.4237000      0.9400000    
 H  -0.8297000      -1.327000      0.9576000    
 H   0.8379000      -1.312600     -0.9561000    
 H   0.8369000      0.4381000     -0.9312000    
 H   -1.668200      -1.384900      -1.391500    
 H   -1.675900      0.3979000      -1.424900    
 H    1.676600      0.4223000       1.421500    
 H    1.664400      -1.360600       1.405600    
 H   -4.016600      -1.405500      -1.728400    
 H   -4.012900      0.3754000      -1.775600    
 H    4.012100      -1.385200       1.743300    
 H    4.014400      0.3962000       1.771500    
 H   -5.519200      -1.368600      0.2446000    
 H   -6.252000     -0.5555000      -1.145100    
 H    5.514300      -1.374600     -0.2302000    
 H    6.250400     -0.5492000       1.150700    


%chk=000087745-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000087745

0 1
O -3.090457 -0.572098 -0.211343
O 3.089533 -0.569697 0.216719
N -5.766337 1.846279 1.003609
N 5.765162 1.839864 -1.016256
C -0.722070 -0.559461 0.279047
C 0.721141 -0.564301 -0.274116
C -1.763254 -0.527222 -0.843026
C 1.762206 -0.517010 0.847518
C -4.183069 -0.487174 -1.174697
C 4.181917 -0.476503 1.179591
C -5.492458 -0.425792 -0.364387
C 5.491464 -0.421715 0.369057
C -5.638733 0.827328 0.396800
C 5.638260 0.825590 -0.401516
H -0.884937 0.319545 0.931902
H -0.900599 -1.458909 0.899457
H 0.898591 -1.472751 -0.881570
H 0.885095 0.305072 -0.939509
H -1.638135 -1.398159 -1.526067
H -1.663383 0.402738 -1.446364
H 1.661899 0.420765 1.438530
H 1.637247 -1.378922 1.541960
H -4.201893 -1.386691 -1.829307
H -4.075924 0.412979 -1.817760
H 4.200644 -1.370537 1.841663
H 4.074549 0.428960 1.815106
H -5.512621 -1.277952 0.339677
H -6.357220 -0.532075 -1.046365
H 5.511366 -1.279173 -0.328557
H 6.356116 -0.523179 1.051905


