%chk=000114243.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114243

0 1
 O   -3.833200       1.626800       1.168500    
 O    6.239700      -2.183900     -0.4548000    
 O   -6.672300      -2.191900     -0.7092000    
 O   -4.748900      -3.018100      0.1723000    
 C   -1.481900       1.097600      0.6621000    
 C  -0.7982000      0.7926000     -0.6879000    
 C   0.7212000       1.004200     -0.6541000    
 C    1.340900      7.3200002E-02  0.4347000    
 C   -2.981700      0.9143000      0.2736000    
 C  -0.9083000      0.1255000       1.706400    
 C    2.912000      0.1894000      0.5182000    
 C   -1.621500       1.592100      -1.692800    
 C   0.6250000      0.2279000       1.804200    
 C   -3.059200       1.544800      -1.142900    
 C    1.356700      0.7106000      -2.019300    
 C   -1.251300       2.555600       1.157800    
 C    3.510300      6.5099999E-02 -0.8890000    
 C    2.867900      0.8954000      -1.974900    
 C   -3.482800     -0.5354000      0.2500000    
 C    3.439800     -0.9612000       1.424200    
 C    3.360700       1.542400       1.115200    
 C    4.935800      -1.201400       1.295900    
 C    4.565900     -0.7095000      -1.190800    
 C   -4.930000     -0.6393000     -0.2003000    
 C    5.305600      -1.448500     -0.1424000    
 C   -5.412200      -2.068400     -0.2248000    
 H  -0.9533000     -0.2682000     -0.9361000    
 H   0.9339000       2.050800     -0.4113000    
 H    1.123600     -0.9563000      0.1056000    
 H   -1.148400     -0.9117000       1.445000    
 H   -1.354200      0.3105000       2.690900    
 H   -1.566800       1.159700      -2.697400    
 H   -1.274500       2.629200      -1.761600    
 H   0.8929000       1.180600       2.270800    
 H   0.9636000     -0.5546000       2.492400    
 H   -3.475600       2.558700      -1.104500    
 H   -3.675300      0.9902000      -1.852400    
 H   0.9436000       1.381800      -2.781200    
 H    1.118600     -0.3135000      -2.335100    
 H   -1.684900       3.300200      0.4824000    
 H   -1.711200       2.705500       2.141600    
 H  -0.1940000       2.809400       1.265900    
 H    3.103200       1.952500      -1.800000    
 H    3.280000      0.6491000      -2.961300    
 H   -2.859000      -1.162400     -0.3967000    
 H   -3.418900     -0.9606000       1.260200    
 H    2.923500      -1.896400       1.165400    
 H    3.210100     -0.7618000       2.477700    
 H    2.905800       2.394500      0.6008000    
 H    3.099700       1.621800       2.175800    
 H    4.446900       1.673000       1.044400    
 H   -3.712300       1.249900       2.056800    
 H    5.208600      -2.086000       1.882000    
 H    5.518400     -0.3532000       1.668700    
 H    4.953300     -0.7816000      -2.201500    
 H   -5.586100     -8.8900000E-02  0.4830000    
 H   -5.079900     -0.2557000      -1.211600    
 H   -6.975700      -3.124700     -0.7075000    


%chk=000114243-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114243

0 1
O -3.944985 1.653893 1.085092
O 6.382015 -2.209765 -0.442736
O -6.651440 -2.377190 -0.700962
O -5.214027 -2.759870 1.078352
C -1.491707 1.065541 0.638336
C -0.775361 0.861902 -0.733185
C 0.755077 1.056111 -0.673227
C 1.357630 0.077660 0.386661
C -3.009855 0.904262 0.205793
C -0.913556 0.028660 1.632861
C 2.935017 0.182056 0.516446
C -1.598266 1.733937 -1.714076
C 0.628171 0.175968 1.758027
C -3.066698 1.614680 -1.190143
C 1.405224 0.806573 -2.051832
C -1.296863 2.504475 1.195901
C 3.555350 0.075029 -0.888856
C 2.945788 0.934078 -1.981475
C -3.485336 -0.573716 0.174066
C 3.441824 -0.992719 1.411040
C 3.373673 1.546872 1.139107
C 4.958810 -1.252278 1.308744
C 4.641306 -0.719215 -1.161577
C -4.940787 -0.725659 -0.313832
C 5.395506 -1.470118 -0.138709
C -5.561260 -2.037766 0.116018
H -0.936086 -0.202078 -1.023917
H 0.971158 2.103708 -0.376671
H 1.158615 -0.947144 -0.007603
H -1.137284 -0.998497 1.283573
H -1.371950 0.134623 2.638171
H -1.505303 1.393505 -2.760240
H -1.249710 2.783698 -1.682055
H 0.865120 1.138754 2.248091
H 0.998110 -0.618168 2.432629
H -3.540316 2.602303 -1.056722
H -3.697279 1.050682 -1.898346
H 1.012899 1.523635 -2.797627
H 1.133368 -0.210163 -2.404171
H -1.789717 3.259443 0.561882
H -1.744839 2.593366 2.201756
H -0.230670 2.773058 1.282238
H 3.194328 1.997719 -1.776498
H 3.405148 0.686242 -2.955705
H -2.813604 -1.178825 -0.463617
H -3.420933 -1.004037 1.192527
H 2.906367 -1.916850 1.112272
H 3.178872 -0.794641 2.466462
H 2.991714 2.408480 0.563870
H 3.005875 1.641602 2.176026
H 4.474814 1.628905 1.164059
H -3.902535 1.260022 1.995212
H 5.261077 -2.130294 1.906494
H 5.530511 -0.388260 1.706082
H 5.033674 -0.789413 -2.184810
H -5.549763 0.092303 0.124275
H -5.041307 -0.634486 -1.408562
H -7.060002 -3.220896 -0.363808


