%chk=000096091.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096091

0 1
 O   0.5838000      -2.408700     -3.1800002E-02
 O  -0.5844000       2.408200     -3.2000002E-02
 C  -3.0000001E-04 -3.0000001E-04  -1.346700    
 C   -1.036600     -0.7086000     -0.5261000    
 C    1.044500      0.7140000     -0.5193000    
 C   -2.335000     -0.1917000     -0.3870000    
 C    2.334300      0.1913000     -0.3871000    
 C   -3.279400     -0.8946000      0.3985000    
 C    3.278600      0.8942000      0.3984000    
 C  -0.6744000      -1.901200      0.1006000    
 C   0.6737000       1.900800      0.1005000    
 C   -2.897500      -2.093700       1.021900    
 C    2.896700       2.093300       1.021700    
 C   -1.603000      -2.592500      0.8731000    
 C    1.602300       2.592100      0.8729000    
 C   -2.716900       1.007300      -1.010500    
 C    2.716200      -1.007900      -1.010400    
 C   -4.577800     -0.3778000      0.5375000    
 C    4.577100      0.3773000      0.5373000    
 C   -4.011300       1.506300     -0.8616000    
 C    4.010600      -1.506800     -0.8615000    
 C   -4.939900      0.8152000     -8.8900000E-02
 C    4.939200     -0.8156000     -8.9000002E-02
 C   0.8628000      -3.632400      0.6447000    
 C  -0.8634000       3.632000      0.6446000    
 H   0.4116000     -0.7198000      -2.059500    
 H  -0.4080000      0.7233000      -2.058000    
 H   -3.608000      -2.649800       1.630400    
 H    3.607200       2.649400       1.630000    
 H   -1.395600      -3.523300       1.389400    
 H    1.394900       3.522900       1.389200    
 H   -2.082900       1.580200      -1.675400    
 H    2.082200      -1.581000      -1.675000    
 H   -5.320200     -0.9016000       1.136100    
 H    5.319500      0.9012000       1.135800    
 H   -4.298600       2.428400      -1.358700    
 H    4.297900      -2.429000      -1.358600    
 H   -5.948100       1.202700      2.4300000E-02
 H    5.947500      -1.203100      2.4200000E-02
 H    1.905200      -3.890100      0.4297000    
 H   0.2494000      -4.455200      0.2620000    
 H   0.7830000      -3.520500       1.731400    
 H  -0.7837000       3.520100       1.731300    
 H   -1.905700       3.889700      0.4294000    
 H  -0.2500000       4.454700      0.2618000    


%chk=000096091-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000096091

0 1
O 0.485658 -2.277131 0.147292
O -0.485665 2.277417 0.148760
C 0.000112 0.000606 -1.300909
C -1.125980 -0.643136 -0.483023
C 1.126015 0.643642 -0.482151
C -2.481918 -0.148288 -0.469423
C 2.481857 0.148586 -0.468374
C -3.495143 -0.840181 0.313440
C 3.494920 0.839877 0.315228
C -0.835702 -1.809934 0.256832
C 0.835626 1.809990 0.258379
C -3.129248 -1.998360 1.065868
C 3.128943 1.997673 1.068203
C -1.823067 -2.482511 1.040970
C 1.822823 2.481994 1.043224
C -2.902214 1.014309 -1.208139
C 2.902214 -1.013691 -1.207567
C -4.847478 -0.359752 0.321249
C 4.847180 0.359231 0.323232
C -4.227013 1.452878 -1.188289
C 4.226933 -1.452478 -1.187510
C -5.217014 0.763103 -0.417570
C 5.216784 -0.763271 -0.416089
C 0.906997 -3.406669 0.975234
C -0.907046 3.406419 0.977400
H 0.428355 -0.772194 -1.960689
H -0.427906 0.773946 -1.960199
H -3.894788 -2.511486 1.659814
H 3.894374 2.510350 1.662676
H -1.562326 -3.378765 1.611425
H 1.562035 3.377950 1.614124
H -2.165323 1.581225 -1.781532
H 2.165409 -1.580173 -1.781495
H -5.590590 -0.900932 0.919973
H 5.590174 0.899951 0.922516
H -4.514361 2.338306 -1.767260
H 4.514349 -2.337637 -1.766860
H -6.253014 1.119283 -0.411561
H 6.252719 -1.119637 -0.409915
H 1.980432 -3.522588 0.762638
H 0.368292 -4.335565 0.702755
H 0.763870 -3.194279 2.052257
H -0.764134 3.193277 2.054304
H -1.980435 3.522593 0.764699
H -0.368205 4.335454 0.705659


