%chk=000006785.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006785

0 1
 O    1.138300      0.4809000     -0.1626000    
 O   -2.710100      -1.630300      0.5821000    
 O    4.565200     -0.5570000     -0.1686000    
 O  -0.2240000     -0.7929000      -1.512000    
 O   -3.157800      -1.163700      -1.627100    
 O    3.501400       1.174100      0.9267000    
 C   -1.131000       1.021000     -0.2581000    
 C   -2.446800      0.5699000     -0.1526000    
 C  -0.8156000       2.336900      8.0700003E-02
 C   -3.447000       1.434900      0.2917000    
 C  -6.4000003E-02  0.1418000     -0.7182000    
 C   -1.815900       3.201600      0.5250000    
 C   -3.131600       2.750700      0.6304000    
 C   -2.808000     -0.7987000     -0.4986000    
 C    2.269200     -0.3119000     -0.5397000    
 C   -3.039200      -3.007100      0.3679000    
 C    3.489400      0.2126000      0.1702000    
 C    5.807300     -0.1784000      0.4332000    
 C   -2.872100      -3.762300       1.669300    
 C    6.892300      -1.122100     -3.9799999E-02
 H   0.1963000       2.724800     -3.4000000E-03
 H   -4.476100       1.095200      0.3780000    
 H   -1.571300       4.227200      0.7856000    
 H   -3.910400       3.424300      0.9755000    
 H    2.100400      -1.350000     -0.2356000    
 H    2.425400     -0.2306000      -1.620200    
 H   -4.076600      -3.083800      2.4200000E-02
 H   -2.371700      -3.425800     -0.3932000    
 H    6.056400      0.8481000      0.1416000    
 H    5.716900     -0.2350000       1.523700    
 H   -3.115600      -4.820700       1.541300    
 H   -1.843100      -3.677600       2.034300    
 H   -3.520100      -3.341300       2.445000    
 H    6.982300      -1.090000      -1.130600    
 H    6.648400      -2.155300      0.2287000    
 H    7.857900     -0.8609000      0.4022000    


%chk=000006785-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006785

0 1
O 0.800893 -0.028523 1.235833
O -2.449357 -1.601376 0.226275
O 4.291310 -0.727845 0.392259
O 0.105506 -0.804468 -0.855715
O -3.980301 -0.747201 -1.309461
O 2.977440 1.150186 -0.066415
C -1.135235 0.988247 0.283111
C -2.485995 0.768095 -0.113781
C -0.733251 2.279589 0.707724
C -3.395646 1.853458 -0.115867
C -0.068972 -0.049109 0.123463
C -1.654213 3.348651 0.721602
C -2.986104 3.138338 0.297839
C -3.043100 -0.570913 -0.492632
C 2.022254 -0.825538 1.094108
C -2.865979 -2.987329 -0.147183
C 3.110592 0.003794 0.408068
C 5.468290 -0.070523 -0.267049
C -2.032985 -3.939133 0.704256
C 6.621619 -1.064637 -0.201635
H 0.310347 2.436153 0.994888
H -4.424349 1.666897 -0.440089
H -1.328637 4.342514 1.046268
H -3.701626 3.967292 0.293471
H 2.333495 -1.098711 2.113818
H 1.831328 -1.737074 0.499668
H -3.950816 -3.084407 0.039994
H -2.686484 -3.117370 -1.229416
H 5.181058 0.183575 -1.302940
H 5.682628 0.868402 0.274435
H -2.302265 -4.984807 0.468037
H -0.957233 -3.801826 0.500910
H -2.212605 -3.767872 1.779486
H 6.369121 -1.997789 -0.733135
H 6.870700 -1.314360 0.843769
H 7.517671 -0.625780 -0.676964


