%chk=000086028.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086028

0 1
 O   -2.141400      0.2141000     -0.8800000    
 O    4.079400     -7.0200004E-02 -0.4880000    
 C    1.361900       1.340300     -9.5799997E-02
 C    1.886900     -1.7300000E-02  0.4702000    
 C    1.284300      -1.301200     -0.1967000    
 C  -0.1867000       1.335700      1.0100000E-02
 C  -0.1620000      -1.087400     -0.6105000    
 C  -0.8201000      7.7699997E-02 -0.5059000    
 C    1.894000       2.512600      0.7598000    
 C    1.766400       1.614900      -1.559200    
 C    1.301400      -2.450000      0.8397000    
 C    2.073900      -1.790100      -1.429600    
 C    3.391300     -7.4900001E-02  0.5316000    
 C    4.010900     -0.1358000       1.901600    
 C   -3.000600     -6.1200000E-02  0.2085000    
 C   -4.443300      8.1500001E-02 -0.2554000    
 C   -5.429000     -0.1873000      0.8781000    
 C   -6.867100     -1.5000000E-03  0.4215000    
 H    1.548800     -3.1700000E-02   1.519400    
 H  -0.5931000       2.199400     -0.5326000    
 H  -0.4885000       1.460100       1.058600    
 H  -0.6969000      -1.947900      -1.009000    
 H    1.440300       3.461700      0.4512000    
 H    1.662900       2.368500       1.821200    
 H    2.979300       2.624100      0.6632000    
 H    1.407700       2.603300      -1.873300    
 H    2.849900       1.622300      -1.700700    
 H    1.327900      0.8996000      -2.258600    
 H   0.7194000      -2.194000       1.733100    
 H   0.8720000      -3.370000      0.4243000    
 H    2.321800      -2.685300       1.161000    
 H    1.539200      -2.604300      -1.936300    
 H    2.232900      -1.011100      -2.177300    
 H    3.050200      -2.203600      -1.153400    
 H    3.745500      0.7588000       2.469700    
 H    3.668000      -1.030400       2.426300    
 H    5.099600     -0.1811000       1.808400    
 H   -2.811200      0.6419000       1.029500    
 H   -2.836300      -1.082200      0.5769000    
 H   -4.628000     -0.6058000      -1.090500    
 H   -4.595200       1.090700     -0.6587000    
 H   -5.229300      0.4918000       1.715200    
 H   -5.297800      -1.209600       1.251200    
 H   -7.039600       1.022300      7.4400000E-02
 H   -7.110600     -0.6874000     -0.3962000    
 H   -7.556100     -0.2004000       1.248400    


%chk=000086028-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086028

0 1
O -2.167233 -0.421379 -0.584532
O 4.189242 0.371417 -0.466505
C 1.240493 1.222551 0.032617
C 1.967560 -0.110472 0.476382
C 1.522613 -1.413067 -0.310618
C -0.285026 1.016570 0.283314
C 0.014488 -1.369454 -0.528949
C -0.787869 -0.309179 -0.256267
C 1.726733 2.389007 0.936528
C 1.470440 1.616412 -1.450477
C 1.835006 -2.656394 0.583339
C 2.242557 -1.639231 -1.674709
C 3.495609 0.050568 0.539134
C 4.156018 -0.170825 1.896784
C -3.128937 0.184780 0.362120
C -4.533292 -0.118325 -0.166050
C -5.639812 0.479891 0.733892
C -7.058641 0.160812 0.215805
H 1.628572 -0.279071 1.521303
H -0.832241 1.844668 -0.211336
H -0.499159 1.100724 1.369988
H -0.448150 -2.277730 -0.937700
H 1.114029 3.292320 0.755678
H 1.640942 2.135057 2.011459
H 2.778072 2.652702 0.721095
H 1.115117 2.651750 -1.614680
H 2.541148 1.568261 -1.708906
H 0.909931 0.958273 -2.135848
H 1.341912 -2.578176 1.569913
H 1.467665 -3.577841 0.094935
H 2.924504 -2.776119 0.736710
H 1.822176 -2.544216 -2.152848
H 2.109490 -0.795689 -2.367039
H 3.326936 -1.794068 -1.539682
H 3.812692 0.606423 2.607568
H 3.856721 -1.145475 2.324762
H 5.252360 -0.119132 1.804934
H -2.968251 1.281138 0.430799
H -2.982378 -0.255376 1.371963
H -4.658848 -1.215504 -0.241258
H -4.622045 0.284463 -1.193576
H -5.509418 1.579545 0.800282
H -5.528014 0.089040 1.766212
H -7.208772 0.564753 -0.802933
H -7.226960 -0.931463 0.170937
H -7.834975 0.596662 0.870857


