%chk=000072861.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072861

0 1
 O  -2.4999999E-03   1.523500      3.0800000E-02
 O   2.0400001E-02  -2.430000     -0.6217000    
 C  -6.9999998E-04  -1.384200      0.3469000    
 C    1.249600     -0.5688000      0.1711000    
 C   -1.251400     -0.5702000      0.1690000    
 C    1.179700      0.8212000      3.5500001E-02
 C   -1.183500      0.8198000      3.2699998E-02
 C    2.506400      -1.190800      0.1487000    
 C   -2.507100      -1.194600      0.1506000    
 C    2.345600       1.579200     -0.1071000    
 C   -2.350800       1.575400     -0.1108000    
 C    3.669900     -0.4346000      1.7000000E-03
 C   -3.671600     -0.4405000      2.9000000E-03
 C    3.589300      0.9502000     -0.1241000    
 C   -3.593400      0.9443000     -0.1261000    
 H  -8.9999998E-04  -1.831000       1.348100    
 H    2.588700      -2.269600      0.2561000    
 H   -2.589300      -2.272700      0.2649000    
 H    2.290700       2.659800     -0.2094000    
 H   -2.297900       2.656100     -0.2140000    
 H    4.638400     -0.9259000     -1.1100000E-02
 H   -4.639500     -0.9332000     -6.8000001E-03
 H    4.494600       1.539400     -0.2369000    
 H   -4.499800       1.531700     -0.2388000    
 H  -0.7652000      -2.395100      -1.190600    


%chk=000072861-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072861

0 1
O -0.024512 1.534300 -0.132830
O -0.047711 -2.539783 -0.721952
C -0.035396 -1.425136 0.273664
C 1.228987 -0.589876 0.153494
C -1.293549 -0.578125 0.171925
C 1.185499 0.810929 -0.050137
C -1.239858 0.822273 -0.032315
C 2.502658 -1.207848 0.231622
C -2.571700 -1.184063 0.268803
C 2.362403 1.581420 -0.181292
C -2.411289 1.603798 -0.146027
C 3.688322 -0.457739 0.107479
C -3.751959 -0.422803 0.162263
C 3.614534 0.943676 -0.101022
C -3.668055 0.977883 -0.047243
H -0.031147 -1.997490 1.219345
H 2.542445 -2.293430 0.374504
H -2.619706 -2.269237 0.412320
H 2.272917 2.660007 -0.340947
H -2.313997 2.681530 -0.306912
H 4.662099 -0.954111 0.170413
H -4.729324 -0.909992 0.239717
H 4.531040 1.535157 -0.199885
H -4.580292 1.578027 -0.132472
H -0.052706 -2.139968 -1.630912


