%chk=000057762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057762

0 1
 O    1.562000     -0.4202000      0.1284000    
 O   -4.221500       1.891500     -0.4717000    
 O   -4.803700     -0.3041000     -0.5553000    
 O    4.489300     -0.1978000      -1.931200    
 O    4.173700      0.3420000      0.2590000    
 C  -0.6658000      -1.247900     -0.1187000    
 C  -0.2468000       1.130500     -5.3300001E-02
 C   0.2264000     -0.1810000     -1.3500000E-02
 C  -0.1783000      -2.658700     -7.7699997E-02
 C   0.6928000       2.285700      5.7999998E-02
 C  -0.1411000      -3.217700       1.350800    
 C   0.9054000       2.721700       1.513700    
 C   -2.031500      -1.003400     -0.2638000    
 C   -1.612500       1.375100     -0.1981000    
 C   -2.504700      0.3082000     -0.3035000    
 C   0.3238000      -4.665000       1.381500    
 C    1.888900       3.876100       1.622000    
 C   -3.928800      0.5621000     -0.4537000    
 C    2.330700     -0.5227000      -1.067500    
 C    3.741800     -7.4600004E-02 -0.8054000    
 H   0.8051000      -2.763600     -0.5423000    
 H  -0.8398000      -3.285300     -0.6916000    
 H   0.2977000       3.133100     -0.5187000    
 H    1.656900       2.060700     -0.4093000    
 H   0.5304000      -2.612800       1.972100    
 H   -1.137100      -3.152900       1.806000    
 H  -5.1100001E-02   3.021100       1.959300    
 H    1.280600       1.878700       2.106700    
 H   -2.722600      -1.839400     -0.3427000    
 H   -1.952900       2.407200     -0.2231000    
 H    1.333100      -4.760700      0.9685000    
 H   0.3410000      -5.036200       2.411000    
 H  -0.3480000      -5.304700      0.8004000    
 H    2.868400       3.594300       1.222400    
 H    1.529800       4.749700       1.068800    
 H    2.019600       4.166300       2.669100    
 H    1.910900      0.1030000      -1.863900    
 H    2.361800      -1.566600      -1.391300    
 H   -5.184000       2.052000     -0.5727000    
 H    5.416600      8.8200003E-02  -1.787800    


%chk=000057762-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000057762

0 1
O 1.498374 -0.452368 0.088984
O -4.414204 1.944162 -0.624437
O -4.959437 -0.310699 -0.683999
O 4.625931 -0.362471 -1.730994
O 3.976406 0.947122 0.081535
C -0.786518 -1.277043 -0.201255
C -0.317923 1.178683 -0.150109
C 0.111779 -0.177511 -0.117727
C -0.295830 -2.709362 -0.078239
C 0.657675 2.325489 0.050684
C -0.022387 -3.117828 1.397524
C 1.031579 2.524319 1.547900
C -2.159826 -0.988534 -0.353099
C -1.701484 1.422032 -0.304724
C -2.621508 0.350095 -0.410708
C 0.470557 -4.574892 1.516196
C 2.065769 3.652553 1.737682
C -4.078195 0.578590 -0.582111
C 2.326328 -0.485681 -1.114903
C 3.690385 0.124463 -0.806747
H 0.639020 -2.854146 -0.653144
H -1.050264 -3.395348 -0.509109
H 0.213570 3.260732 -0.341280
H 1.598868 2.153103 -0.502927
H 0.729835 -2.426977 1.821733
H -0.950735 -2.984497 1.986550
H 0.111668 2.741542 2.126114
H 1.446860 1.575210 1.933047
H -2.891490 -1.800357 -0.430502
H -2.073721 2.450422 -0.335878
H 1.414561 -4.722536 0.957990
H 0.657446 -4.847656 2.570755
H -0.274981 -5.285088 1.110857
H 3.010581 3.396628 1.224330
H 1.696766 4.613300 1.329828
H 2.293698 3.806319 2.808351
H 1.868206 0.094213 -1.942148
H 2.469607 -1.525516 -1.464147
H -5.399264 2.021792 -0.737955
H 5.508799 0.069640 -1.573018


