%chk=000094979.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094979

0 1
 O   -1.155900      -3.357200      0.2304000    
 O    4.777100       1.606700     -7.5400002E-02
 O   -4.632300       1.818500     -0.1588000    
 O   0.8053000      -2.891100       1.272700    
 C   6.0999999E-03  -1.377300     -0.4801000    
 C    1.266900     -0.5884000     -0.3734000    
 C   -1.256100     -0.5082000     -0.3928000    
 C    2.165000     -0.5606000      -1.440100    
 C   -1.767500      2.0500001E-02  -1.552600    
 C    1.548400      0.1213000      0.7941000    
 C   -1.819100     -0.2960000      0.8419000    
 C  -5.3300001E-02  -2.593400      0.4541000    
 C    3.344700      0.1770000      -1.339500    
 C   -2.914000      0.8110000      -1.472700    
 C    2.728100      0.8589000      0.8946000    
 C   -2.965700      0.4943000      0.9218000    
 C    3.626300      0.8866000     -0.1721000    
 C   -3.513100       1.047900     -0.2356000    
 C    5.003000       2.309000       1.146100    
 C   -5.193900       2.020600       1.137300    
 H  -6.5000001E-03  -1.846700      -1.477200    
 H    1.962300      -1.107100      -2.357300    
 H   -1.305400     -0.1577000      -2.518400    
 H   0.8748000      0.1056000       1.645400    
 H   -1.408000     -0.7147000       1.754600    
 H    4.040500      0.1951000      -2.174000    
 H   -3.335600       1.239800      -2.377800    
 H    2.886000       1.384100       1.830400    
 H   -3.379500      0.6384000       1.914100    
 H   -1.176700      -4.146900      0.8119000    
 H    5.095100       1.621900       1.994000    
 H    4.240900       3.077300       1.315200    
 H    5.962700       2.826800       1.048500    
 H   -5.538100       1.078700       1.577900    
 H   -6.076700       2.656100       1.011500    
 H   -4.503500       2.558900       1.795400    


%chk=000094979-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094979

0 1
O 0.130256 -3.795182 -0.324393
O 4.930826 1.410780 -0.084836
O -4.748783 2.008381 -0.095696
O -0.107668 -2.618132 1.657065
C -0.103109 -1.403696 -0.528852
C 1.216757 -0.618381 -0.377060
C -1.357664 -0.540912 -0.331413
C 2.249123 -0.784179 -1.336581
C -1.867153 0.161482 -1.457661
C 1.441926 0.249707 0.715243
C -2.009577 -0.373262 0.912408
C -0.047424 -2.611297 0.407387
C 3.470167 -0.096368 -1.215308
C -2.988557 1.000600 -1.349841
C 2.662731 0.945595 0.855169
C -3.142504 0.464813 1.037372
C 3.681104 0.772172 -0.115822
C -3.633740 1.154673 -0.096635
C 5.201127 2.312354 1.037245
C -5.456214 2.191776 1.173251
H -0.125400 -1.815955 -1.552108
H 2.096898 -1.460487 -2.186449
H -1.374278 0.051804 -2.431332
H 0.656265 0.391239 1.464557
H -1.640494 -0.908788 1.792997
H 4.269667 -0.214423 -1.952871
H -3.384623 1.540206 -2.215422
H 2.804985 1.611644 1.711608
H -3.625582 0.565435 2.013984
H 0.206528 -4.561245 0.308380
H 5.163569 1.774392 2.004581
H 4.486915 3.158638 1.055655
H 6.219085 2.690630 0.862926
H -5.862805 1.233115 1.550609
H -6.282805 2.880496 0.944695
H -4.797249 2.642074 1.941248


