%chk=000074816.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074816

0 1
 O   -2.365200       1.742800      0.7044000    
 O    2.617600       1.298700      -1.194900    
 C   -2.500000      0.4889000     -3.8000001E-03
 C    2.499300      0.4956000      2.2000000E-03
 C   -1.207400     -0.2545000      7.9999998E-04
 C    1.208600     -0.2513000      3.8999999E-03
 C  -1.9999999E-04  0.4445000     -6.0000003E-04
 C   -3.673800     -0.2383000      0.7010000    
 C   -2.926300      0.8384000      -1.447500    
 C    3.768600     -0.3945000      7.4000000E-03
 C    2.570300       1.470400       1.199300    
 C   -1.205400      -1.649400      6.8000001E-03
 C    1.210500      -1.646100      9.8000001E-03
 C   3.4000000E-03  -2.345200      1.1100000E-02
 H  -3.5999999E-03   1.530500     -2.8899999E-02
 H   -4.535600      0.4327000      0.8013000    
 H   -3.394700     -0.5375000       1.718200    
 H   -4.007100      -1.125700      0.1536000    
 H   -2.165700       1.453700      -1.942700    
 H   -3.084300     -6.1799999E-02  -2.051200    
 H   -3.850400       1.427800      -1.449000    
 H    3.816700      -1.029800     -0.8850000    
 H    3.832000      -1.019600      0.9045000    
 H    4.670100      0.2299000     -2.7799999E-02
 H    1.798700       2.246600       1.152000    
 H    2.469400      0.9409000       2.153200    
 H    3.527300       2.005900       1.202800    
 H   -2.122200      -2.229500     -7.8999996E-03
 H    2.118700      -2.238400      1.3500000E-02
 H   4.6000001E-03  -3.431400      1.2200000E-02
 H   -2.063400       1.543200       1.607700    
 H    1.900400       1.954900      -1.197900    


%chk=000074816-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000074816

0 1
O -2.362966 1.825018 0.647310
O 2.564479 1.373054 -1.199661
C -2.554749 0.502487 -0.017336
C 2.543737 0.524572 0.032474
C -1.243343 -0.307116 0.053117
C 1.237603 -0.299080 0.065101
C -0.006942 0.382737 0.058175
C -3.750346 -0.213677 0.650368
C -2.878635 0.873626 -1.480238
C 3.814790 -0.326675 -0.112764
C 2.645437 1.442805 1.276728
C -1.228143 -1.725179 0.065469
C 1.225107 -1.714964 0.081282
C 0.000469 -2.418992 0.083434
H -0.049036 1.479701 0.068092
H -4.612239 0.475253 0.668480
H -3.514017 -0.511053 1.689380
H -4.051788 -1.120361 0.096541
H -2.053730 1.464184 -1.913265
H -3.015542 -0.035600 -2.090897
H -3.800844 1.479263 -1.518606
H 3.764189 -0.952789 -1.019434
H 3.973947 -0.971196 0.769511
H 4.681825 0.347141 -0.215334
H 1.766921 2.108075 1.362233
H 2.706569 0.846242 2.205342
H 3.549240 2.071972 1.197201
H -2.165554 -2.291315 0.063110
H 2.165038 -2.274890 0.088455
H 0.004796 -3.514931 0.097251
H -2.177413 1.662481 1.608649
H 1.732041 1.911610 -1.231666


