%chk=000106938.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106938

0 1
 O    2.132500     -0.9968000     -0.1630000    
 O    2.898400      0.6017000       1.314100    
 C   -1.311400      0.4828000      0.2679000    
 C   -2.090700     -0.7204000     -0.3010000    
 C   0.1679000      0.4053000     -0.1261000    
 C   -1.463600      -2.042700      0.1604000    
 C   -1.938700       1.803900     -0.1954000    
 C   -3.571300     -0.6435000      9.3400002E-02
 C   0.7951000     -0.9166000      0.3180000    
 C   1.4000000E-02  -2.115900     -0.2138000    
 C   -3.417900       1.879100      0.1779000    
 C   -4.197500      0.6777000     -0.3482000    
 C    2.975700     -7.9999998E-04  0.2522000    
 C    4.022200      0.2385000     -0.8108000    
 C    4.985200       1.347800     -0.4255000    
 H   -1.369800      0.4496000       1.365600    
 H   -2.032600     -0.6859000      -1.398700    
 H   0.2790000      0.5167000      -1.213300    
 H   0.6945000       1.260600      0.3116000    
 H   -1.994300      -2.887600     -0.2943000    
 H   -1.568500      -2.148500       1.247600    
 H   -1.833600       1.907600      -1.282800    
 H   -1.408600       2.650100      0.2577000    
 H   -3.675300     -0.7483000       1.180900    
 H   -4.123500      -1.474800     -0.3606000    
 H   0.8108000     -0.9735000       1.414600    
 H   0.4533000      -3.044000      0.1717000    
 H   0.1191000      -2.170800      -1.305400    
 H   -3.851600       2.803000     -0.2209000    
 H   -3.515500       1.926300       1.269600    
 H   -5.234400      0.7291000      2.7999999E-03
 H   -4.229400      0.7165000      -1.444100    
 H    4.580500     -0.6911000     -0.9627000    
 H    3.513400      0.5083000      -1.742300    
 H    5.514700       1.104500      0.5017000    
 H    5.728300       1.498700      -1.214500    
 H    4.454100       2.292700     -0.2696000    


%chk=000106938-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106938

0 1
O 2.115638 -0.476267 -0.616985
O 2.938267 0.933587 1.054654
C -1.510647 0.636220 0.126848
C -2.185973 -0.716720 -0.236978
C -0.070160 0.703228 -0.442144
C -1.319832 -1.908465 0.238483
C -2.369382 1.831847 -0.352890
C -3.623868 -0.780937 0.331630
C 0.762616 -0.494258 0.043803
C 0.120500 -1.837365 -0.324125
C -3.810092 1.762685 0.205767
C -4.483351 0.413898 -0.144372
C 3.110513 0.294608 -0.010130
C 4.391578 0.245873 -0.831502
C 5.632459 0.675056 -0.026622
H -1.446534 0.686747 1.238089
H -2.254191 -0.762734 -1.348312
H -0.109512 0.686914 -1.550320
H 0.417091 1.647082 -0.134146
H -1.791127 -2.863494 -0.065447
H -1.285905 -1.910693 1.348422
H -2.406109 1.826506 -1.463001
H -1.887059 2.783761 -0.054205
H -3.572732 -0.776489 1.441312
H -4.100928 -1.737701 0.038790
H 0.928942 -0.414663 1.135882
H 0.737645 -2.667760 0.066084
H 0.098883 -1.932522 -1.427471
H -4.412063 2.604996 -0.187222
H -3.779399 1.878400 1.309122
H -5.493546 0.362335 0.306452
H -4.619583 0.349836 -1.244052
H 4.501753 -0.771547 -1.247118
H 4.246691 0.915808 -1.702998
H 5.829672 -0.024917 0.804105
H 6.524294 0.700429 -0.677338
H 5.485953 1.676017 0.412630


