%chk=000113932.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113932

0 1
 O   -1.077200      0.5465000     -0.7531000    
 O   -4.493100     -0.1674000      0.3227000    
 O   0.8778000      -1.100500      -1.522400    
 O   -3.411500      -2.710000      0.5539000    
 C   -3.212200     -0.4561000     -0.2426000    
 C    2.703200      -1.303600      3.8600001E-02
 C    1.246000      0.8251000     -0.2239000    
 C   -2.370900      0.8151000     -0.2227000    
 C  -4.9699999E-02   1.327500     -0.2951000    
 C    1.547300     -0.5401000     -0.6320000    
 C    2.491700      -2.817200      7.2700001E-02
 C   -2.571100      -1.561300      0.5863000    
 C    2.279000       1.637300      0.2441000    
 C  -0.3222000       2.634700      9.7499996E-02
 C    3.640900      -3.525000      0.7718000    
 C    2.011200       2.948200      0.6387000    
 C   0.7109000       3.446800      0.5654000    
 H   -3.370300     -0.8064000      -1.268200    
 H    2.811300     -0.9474000       1.069700    
 H    3.621400      -1.065100     -0.5104000    
 H   -2.325300       1.176600      0.8142000    
 H   -2.864300       1.585400     -0.8282000    
 H    2.397600      -3.204700     -0.9486000    
 H    1.550900      -3.048300      0.5863000    
 H   -2.454000      -1.267000       1.634700    
 H   -1.592700      -1.849600      0.1916000    
 H    3.305100       1.284700      0.2977000    
 H   -1.311600       3.076000      2.8100001E-02
 H    4.588900      -3.335100      0.2584000    
 H    3.470400      -4.606000      0.7816000    
 H    3.737400      -3.187100       1.808500    
 H    2.816300       3.582700      0.9979000    
 H   0.5047000       4.470300      0.8650000    
 H   -4.358300      0.1291000       1.239000    
 H   -4.279300      -2.446200      0.9049000    


%chk=000113932-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113932

0 1
O -1.127840 0.326416 -0.097052
O -4.807073 0.020713 -0.498910
O 0.490790 -1.647295 0.814473
O -4.101340 -2.586557 0.495593
C -3.388341 -0.404586 -0.388731
C 2.852717 -1.379247 0.294858
C 1.207275 0.639473 0.402159
C -2.499152 0.837180 -0.222244
C -0.085824 1.212946 0.155355
C 1.425174 -0.847642 0.520285
C 2.917718 -2.915365 0.186424
C -3.229218 -1.436648 0.739441
C 2.298113 1.532729 0.582739
C -0.258060 2.620490 0.135996
C 4.364145 -3.424105 0.013415
C 2.132737 2.932319 0.562695
C 0.846142 3.472497 0.344317
H -3.189420 -0.892678 -1.356615
H 3.491495 -1.047515 1.141871
H 3.281775 -0.905406 -0.610860
H -2.775280 1.403480 0.695141
H -2.602476 1.500650 -1.103316
H 2.292743 -3.246157 -0.664499
H 2.456917 -3.360508 1.086678
H -3.463832 -0.955452 1.719427
H -2.195913 -1.815356 0.772782
H 3.295195 1.121201 0.765575
H -1.244138 3.054995 -0.051573
H 4.832324 -3.008974 -0.899560
H 4.389666 -4.525927 -0.067984
H 4.996461 -3.136512 0.875295
H 2.991988 3.591541 0.719987
H 0.698788 4.558056 0.328901
H -5.068302 0.484043 0.340760
H -4.977652 -2.230899 0.189280


