%chk=000156398.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156398

0 1
 O   -1.451900       1.973100      0.2757000    
 O   -5.098500      -2.149000     -0.1833000    
 O   -5.935700      0.4679000      0.2299000    
 O    5.977100     -0.4178000     -8.0300003E-02
 C   0.4053000      0.5362000     -0.4386000    
 C  -0.4122000     -0.7375000     -0.1892000    
 C  -8.4399998E-02   1.623400      0.5238000    
 C   -1.875100     -0.4080000     -7.4900001E-02
 C    1.894800      0.2811000     -0.3432000    
 C   -2.305000      0.9053000      0.1588000    
 C   -2.828600      -1.429600     -0.1774000    
 C    2.710600      0.4904000      -1.454600    
 C    2.449500     -0.1625000      0.8567000    
 C   -3.669000       1.194900      0.2481000    
 C   -4.189600      -1.139900     -7.4699998E-02
 C   -4.609400      0.1721000      0.1337000    
 C    4.082800      0.2557000      -1.366000    
 C    3.821600     -0.3971000      0.9454000    
 C    4.638300     -0.1881000     -0.1660000    
 C    6.479200     -0.8704000       1.176200    
 H   0.1695000      0.8776000      -1.457800    
 H  -0.1106000      -1.238600      0.7387000    
 H  -0.2473000      -1.443900      -1.012600    
 H   1.7000001E-02   1.329100       1.576400    
 H   0.5058000       2.537800      0.3916000    
 H   -2.500800      -2.453600     -0.3433000    
 H    2.292900      0.8359000      -2.396400    
 H    1.832400     -0.3272000       1.735600    
 H   -3.999200       2.217800      0.4132000    
 H    4.713900      0.4202000      -2.235100    
 H    4.187300     -0.7395000       1.907400    
 H   -4.626400      -2.987300     -0.3257000    
 H   -6.441300     -0.3572000      0.1283000    
 H    6.065000      -1.847700       1.446700    
 H    6.327600     -0.1233000       1.962700    
 H    7.560400      -1.001600       1.064000    


%chk=000156398-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000156398

0 1
O -1.476783 1.967412 0.286537
O -5.373854 -2.053650 -0.225854
O -6.071760 0.530860 0.123923
O 6.109655 -0.314068 -0.109070
C 0.393362 0.458753 -0.430368
C -0.457615 -0.798039 -0.106512
C -0.061672 1.606273 0.503959
C -1.939905 -0.456157 -0.026987
C 1.894408 0.225570 -0.312954
C -2.372577 0.883335 0.163537
C -2.933901 -1.460515 -0.158987
C 2.758378 0.505418 -1.405846
C 2.480661 -0.248005 0.886929
C -3.745611 1.221949 0.210882
C -4.297247 -1.135523 -0.105342
C -4.710183 0.213198 0.076859
C 4.149052 0.316845 -1.310347
C 3.875615 -0.443389 1.005103
C 4.714147 -0.159402 -0.101142
C 6.743060 -0.804709 1.116884
H 0.161181 0.777798 -1.465576
H -0.112101 -1.232354 0.854182
H -0.281524 -1.572508 -0.876572
H 0.075589 1.317518 1.566900
H 0.495941 2.535671 0.306937
H -2.620988 -2.502213 -0.313506
H 2.332444 0.875332 -2.346452
H 1.847015 -0.474748 1.753278
H -4.051012 2.261014 0.353305
H 4.814619 0.529223 -2.152517
H 4.289524 -0.811061 1.948888
H -5.054886 -2.976607 -0.363794
H -6.593820 -0.307118 0.012880
H 6.378774 -1.816584 1.381990
H 6.570134 -0.113931 1.965237
H 7.817881 -0.846886 0.887415


