%chk=000145696.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145696

0 1
 O   -4.042900       2.532400     -0.3227000    
 O   -4.114600      -1.964600       1.203700    
 O   -6.540300      -2.499100     -1.0500000E-02
 O   -6.465100       1.958700      -1.519100    
 C    3.570200     -0.1882000     -0.1331000    
 C    4.935800      5.9999999E-02  0.5140000    
 C    2.392100      0.1353000      0.7898000    
 C    6.113000     -0.2400000     -0.4166000    
 C    1.056000     -0.1194000      8.7499999E-02
 C    7.449900      3.6300000E-02  0.2754000    
 C  -0.1622000      0.2071000      0.9570000    
 C    8.630500     -0.2988000     -0.6392000    
 C   -1.527500      5.2499998E-02  0.2788000    
 C    9.964800      9.9999998E-03  4.3699998E-02
 C   -2.699700      0.4518000       1.175800    
 C    11.18000     -0.2784000     -0.8402000    
 C   -4.008700      0.2959000      0.4761000    
 C    12.50740      5.1800001E-02 -0.1758000    
 C   -4.610100       1.277700     -0.2129000    
 C   -4.644400      -1.049800      0.5791000    
 C   -5.945500      -1.257500     -0.1002000    
 C   -5.913300       1.062200     -0.8889000    
 C   -6.531000     -0.2717000     -0.7814000    
 C   -4.469900       3.368700      0.7341000    
 C   -6.124500      -3.333000      -1.074300    
 H    3.508100      -1.238000     -0.4457000    
 H    3.492100      0.4184000      -1.044000    
 H    5.020700     -0.5572000       1.417000    
 H    4.991300       1.106300      0.8396000    
 H    2.448900       1.184400       1.103200    
 H    2.454400     -0.4783000       1.696300    
 H    6.032000      0.3744000      -1.321400    
 H    6.069700      -1.289300     -0.7323000    
 H   0.9999000      -1.169700     -0.2237000    
 H    1.009400      0.4844000     -0.8273000    
 H    7.519300     -0.5584000       1.194400    
 H    7.498400       1.092100      0.5687000    
 H  -0.1377000     -0.4294000       1.850600    
 H  -6.7199998E-02   1.241300       1.312300    
 H    8.596200      -1.359500     -0.9152000    
 H    8.553000      0.2804000      -1.567200    
 H   -1.537600      0.6648000     -0.6322000    
 H   -1.642800     -0.9899000     -4.4199999E-02
 H    10.04460     -0.5782000      0.9664000    
 H    9.982800       1.066300      0.3397000    
 H   -2.682300     -0.1386000       2.100300    
 H   -2.547900       1.485400       1.505300    
 H    11.17900      -1.337800      -1.123300    
 H    11.09790      0.2985000      -1.769200    
 H    12.64200     -0.5342000      0.7389000    
 H    12.55950       1.113400      8.5500002E-02
 H    13.33800     -0.1745000     -0.8515000    
 H   -7.484000     -0.4189000      -1.278400    
 H   -3.919800       4.312000      0.6643000    
 H   -4.271700       2.937200       1.720800    
 H   -5.537500       3.597300      0.6422000    
 H   -6.600600      -4.310100     -0.9476000    
 H   -5.039300      -3.483800      -1.064900    
 H   -6.438900      -2.929200      -2.043200    


%chk=000145696-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145696

0 1
O -3.915835 2.392151 0.422146
O -4.266733 -2.339630 0.642002
O -6.835508 -2.298352 -0.735673
O -6.484444 2.412308 -0.962582
C 3.593080 -0.051444 -0.203657
C 4.956815 -0.051470 0.523194
C 2.385250 -0.057418 0.760144
C 6.165575 -0.040075 -0.439438
C 1.021048 -0.048119 0.033982
C 7.528820 -0.035142 0.288371
C -0.184749 -0.043729 1.000227
C 8.738150 -0.021797 -0.673688
C -1.545687 -0.017011 0.271012
C 10.101412 -0.014806 0.054195
C -2.744695 -0.003201 1.262310
C 11.310404 -0.001324 -0.908966
C -4.081651 0.051662 0.555091
C 12.668494 0.006227 -0.174187
C -4.644403 1.253801 0.143702
C -4.768760 -1.217851 0.283474
C -6.104971 -1.171618 -0.439781
C -5.974264 1.301277 -0.582944
C -6.643401 0.034647 -0.833394
C -4.379102 3.772665 0.138562
C -6.421894 -3.681725 -0.393714
H 3.533782 -0.936417 -0.871517
H 3.530455 0.839376 -0.863562
H 5.020881 -0.943437 1.181310
H 5.014109 0.832249 1.193043
H 2.448166 0.825218 1.430924
H 2.444515 -0.950571 1.416952
H 6.099908 0.850629 -1.099214
H 6.110375 -0.925087 -1.107675
H 0.954326 -0.933306 -0.632537
H 0.964530 0.842747 -0.626221
H 7.595011 -0.926133 0.947636
H 7.583278 0.849482 0.957233
H -0.135922 -0.939422 1.654018
H -0.112671 0.837574 1.671818
H 8.684577 -0.907030 -1.341860
H 8.671343 0.868706 -1.333684
H -1.601250 0.878731 -0.378572
H -1.631321 -0.903588 -0.388185
H 10.170093 -0.905204 0.714082
H 10.156723 0.870498 0.722129
H -2.705886 -0.919360 1.878548
H -2.644680 0.874819 1.926412
H 11.254237 -0.886178 -1.575704
H 11.240527 0.888224 -1.568169
H 12.776724 -0.888716 0.467519
H 12.762188 0.896834 0.475793
H 13.515180 0.016396 -0.885275
H -7.602581 0.071873 -1.356415
H -3.567107 4.397903 0.540792
H -5.333448 3.981192 0.646738
H -4.508042 3.928865 -0.943281
H -7.251255 -4.293769 -0.779601
H -6.308781 -3.801056 0.694903
H -5.471040 -3.940568 -0.884460


