%chk=000006782.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006782

0 1
 O   -2.284000     -0.1709000     -0.1275000    
 O    2.155500     -0.2666000     -9.3000000E-03
 O   -2.107800      0.7183000       1.988500    
 O   0.5555000     -0.4956000       1.629700    
 C   -3.651100      -2.042900     -0.8163000    
 C    4.012000      -1.766400     -0.4464000    
 C   -3.211100      -1.141500      0.3405000    
 C    2.785900      -1.476800      0.4237000    
 C   -2.462600      -2.792700      -1.421800    
 C   -4.717800      -3.029600     -0.3468000    
 C    5.046400     -0.6435000     -0.3433000    
 C    4.639000      -3.103000     -5.5799998E-02
 C  -0.8552000       1.659500      0.1911000    
 C   0.4927000       1.365400      0.1405000    
 C   -1.809000      0.7009000      0.8045000    
 C    1.039400      0.1255000      0.6761000    
 C   -1.367200       2.837400     -0.3187000    
 C    1.364400       2.285000     -0.4428000    
 C  -0.4955000       3.756900     -0.9019000    
 C   0.8703000       3.480900     -0.9640000    
 H   -4.077500      -1.412200      -1.606700    
 H    3.690400      -1.820400      -1.494300    
 H   -4.084300     -0.6273000      0.7603000    
 H   -2.742900      -1.740900       1.131300    
 H    2.065500      -2.299100      0.3367000    
 H    3.079400      -1.373100       1.475500    
 H   -2.789100      -3.435300      -2.246400    
 H   -1.970400      -3.425000     -0.6748000    
 H   -1.717100      -2.097100      -1.820600    
 H   -5.059800      -3.657100      -1.176800    
 H   -5.589400      -2.499800      5.1600002E-02
 H   -4.332700      -3.688200      0.4392000    
 H    5.920000     -0.8630000     -0.9665000    
 H    5.390800     -0.5152000      0.6885000    
 H    4.630300      0.3105000     -0.6830000    
 H    5.498200      -3.331600     -0.6953000    
 H    3.915900      -3.918200     -0.1648000    
 H    4.983900      -3.092300      0.9838000    
 H   -2.429600       3.058800     -0.2738000    
 H    2.435600       2.108100     -0.4944000    
 H  -0.8801000       4.688300      -1.307000    
 H    1.549200       4.198700      -1.415200    


%chk=000006782-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000006782

0 1
O -2.128910 -0.103860 -0.158661
O 1.876535 -0.273154 -0.201212
O -3.041038 1.402474 1.373094
O 0.222575 -0.442573 1.430527
C -3.061507 -2.286426 -0.751812
C 3.645201 -1.908362 -0.615296
C -3.130571 -1.130243 0.254475
C 2.417913 -1.590314 0.248569
C -1.667677 -2.954209 -0.759899
C -4.176398 -3.307833 -0.419865
C 4.766966 -0.863837 -0.418030
C 4.139884 -3.336872 -0.281511
C -1.013944 1.987093 0.141678
C 0.333497 1.545195 0.001222
C -2.143560 1.087584 0.555547
C 0.756220 0.193636 0.490062
C -1.341753 3.332591 -0.148578
C 1.313659 2.448702 -0.481655
C -0.356522 4.228461 -0.616028
C 0.971947 3.780694 -0.796863
H -3.256273 -1.864864 -1.758690
H 3.322508 -1.884785 -1.675495
H -4.129581 -0.657086 0.277517
H -2.868519 -1.458242 1.278629
H 1.620168 -2.347445 0.131937
H 2.674348 -1.517962 1.323014
H -1.628710 -3.766629 -1.508919
H -1.438103 -3.388717 0.232105
H -0.882069 -2.217324 -1.000013
H -4.164667 -4.142005 -1.144216
H -5.179983 -2.843857 -0.451821
H -4.030852 -3.738125 0.589632
H 5.629695 -1.087693 -1.071638
H 5.125496 -0.867252 0.629590
H 4.408988 0.153006 -0.655920
H 5.011311 -3.599900 -0.907466
H 3.353499 -4.094253 -0.458455
H 4.453823 -3.410625 0.777517
H -2.376550 3.661728 -0.010544
H 2.343859 2.097964 -0.587705
H -0.625072 5.265886 -0.841675
H 1.740264 4.468331 -1.165847


