%chk=000157181.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157181

0 1
 O    3.756600       2.766500     -0.1689000    
 O    6.020200       2.027800      2.5300000E-02
 O    2.408800      -1.705300     -0.7617000    
 O   -2.338100     -0.3869000      0.1186000    
 O  -0.6010000       1.523200       1.332800    
 O  -0.9585000      -4.506000     -6.8400003E-02
 O    1.802700      -3.901100      -1.044500    
 O   -4.094400     -0.6871000       1.582900    
 O   -7.806500       2.038100     -0.7117000    
 O   -6.013500       2.141100      -2.103400    
 C    4.390700      0.5464000      -1.006500    
 C    3.030600      0.5874000     -0.4272000    
 C    4.826800       2.014000     -0.7937000    
 C  -0.1115000      -1.237700      0.3976000    
 C   0.8392000     -0.1389000      0.2883000    
 C    2.083300     -0.4132000     -0.2949000    
 C   -1.488200      -1.143800      0.9747000    
 C    2.742000       1.865800      1.5600000E-02
 C   0.2377000      -2.449900     -3.7099998E-02
 C   -1.995500      -2.587500      0.9777000    
 C    5.408300     -0.1794000     -0.2179000    
 C   0.5726000       1.167700      0.7361000    
 C    1.527900       2.181200      0.5991000    
 C  -0.9112000      -3.324800      0.2398000    
 C    1.523200      -2.775800     -0.6518000    
 C    6.259400      0.6998000      0.2962000    
 C   -3.630400     -0.2332000      0.5463000    
 C   -4.393200      0.5869000     -0.4718000    
 C  -0.7347000       2.883700       1.737100    
 C   -5.825000      0.8884000     -4.5699999E-02
 C   -6.528300       1.752800      -1.062800    
 H    4.388700      0.2719000      -2.065600    
 H    5.068600       2.500000      -1.747300    
 H   -1.487900     -0.7315000       1.990600    
 H   -2.943800      -2.745400      0.4570000    
 H   -2.045200      -2.985500       1.996400    
 H    5.466400      -1.250200     -9.5200002E-02
 H    1.408600       3.210100      0.9144000    
 H    7.121600      0.5111000      0.9104000    
 H   -4.395000      3.4000002E-02  -1.418600    
 H   -3.847900       1.526800     -0.6207000    
 H  -1.8400000E-02   3.150600       2.522100    
 H   -1.730300       2.982700       2.183400    
 H  -0.7123000       3.569600      0.8831000    
 H   -5.827200       1.415500      0.9149000    
 H   -6.387200     -4.5299999E-02  6.5499999E-02
 H   -8.256500       2.591800      -1.385000    


%chk=000157181-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000157181

0 1
O 3.428798 2.823173 -0.451916
O 5.803946 2.321015 -0.383693
O 2.418554 -1.771269 -0.692130
O -2.411010 -0.836751 0.066763
O -0.835429 1.205426 1.382544
O -0.651823 -4.996813 0.291531
O 2.124939 -4.061825 -0.840420
O -3.681409 0.120813 1.780902
O -7.381125 2.495982 -0.970985
O -5.242756 3.189583 -1.548474
C 4.251184 0.595450 -1.156699
C 2.859678 0.557625 -0.552529
C 4.578292 2.134955 -1.149969
C -0.110433 -1.450989 0.513650
C 0.710771 -0.290534 0.327590
C 1.990104 -0.507020 -0.305077
C -1.529116 -1.512906 1.078107
C 2.479082 1.848224 -0.143065
C 0.320868 -2.731777 0.150181
C -1.875138 -3.010904 1.158994
C 5.342555 0.035281 -0.242172
C 0.384584 1.058891 0.735475
C 1.261032 2.138380 0.502042
C -0.704372 -3.757765 0.484010
C 1.607554 -3.003397 -0.469892
C 6.142940 1.046346 0.167240
C -3.426041 -0.017745 0.562399
C -4.132495 0.687101 -0.581828
C -1.219777 2.533636 1.886537
C -5.552161 1.139723 -0.195764
C -5.988964 2.361408 -0.978925
H 4.284898 0.148563 -2.164895
H 4.697413 2.656548 -2.109003
H -1.645276 -0.971516 2.030077
H -2.820723 -3.242260 0.641280
H -1.975805 -3.357728 2.202853
H 5.415595 -1.014712 0.034544
H 1.029924 3.160789 0.803478
H 7.013051 1.070445 0.820800
H -4.128640 0.038301 -1.473280
H -3.528708 1.577613 -0.850373
H -0.486201 2.897582 2.629330
H -2.197406 2.372695 2.361906
H -1.312111 3.257705 1.055759
H -5.571726 1.404017 0.880918
H -6.298115 0.337935 -0.325646
H -7.636802 3.327107 -1.456674


