%chk=000158325.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158325

0 1
 O   4.2300001E-02 -0.4102000      5.4900002E-02
 O    5.914300     -0.2748000      -1.044400    
 O   -5.829700     -0.3992000       1.162800    
 O    6.089500      -1.531200       1.428200    
 O   -5.981900      -1.658900      -1.309800    
 C   0.7807000       1.853900      7.8000002E-02
 C  -0.7436000       1.837700      3.3100002E-02
 C    1.109700      0.4399000     -0.4125000    
 C   -1.042200      0.4172000      0.5239000    
 C    1.414900       2.948300     -0.7690000    
 C   -1.401000       2.918500      0.8802000    
 C    2.437700     -8.4100001E-02  7.5099997E-02
 C   -2.359600     -0.1348000      3.8199998E-02
 C    3.580100      6.1000001E-02 -0.7146000    
 C   -3.503600     -1.4000000E-02  0.8296000    
 C    2.528000     -0.7158000       1.317000    
 C   -2.438300     -0.7684000      -1.203600    
 C    4.808000     -0.4240000     -0.2641000    
 C   -4.721700     -0.5249000      0.3807000    
 C    3.755700      -1.200800       1.767500    
 C   -3.656100      -1.279200      -1.652400    
 C    4.895700      -1.054800      0.9770000    
 C   -4.797800      -1.157300     -0.8603000    
 C    5.739100      0.3811000      -2.298900    
 C   -6.620000      0.7747000      0.9834000    
 H    1.110300       1.980300       1.118800    
 H   -1.075900       1.956900      -1.007700    
 H    1.071900      0.3853000      -1.508300    
 H   -1.003400      0.3635000       1.619700    
 H    1.122500       2.860300      -1.820800    
 H    1.110800       3.939300     -0.4178000    
 H    2.507000       2.901400     -0.7173000    
 H   -1.118800       3.915700      0.5283000    
 H   -2.491900       2.847600      0.8291000    
 H   -1.106000       2.837300       1.931800    
 H    3.451100      0.5594000      -1.669600    
 H   -3.450100      0.4772000       1.798200    
 H    1.656500     -0.8316000       1.955500    
 H   -1.565400     -0.8656000      -1.843300    
 H    3.818100      -1.688900       2.736300    
 H   -3.702100      -1.767200      -2.622300    
 H    6.767200      -1.344200      0.7554000    
 H   -5.844300      -2.058900      -2.185600    
 H    6.719600      0.4123000      -2.785400    
 H    5.415900       1.419700      -2.170000    
 H    5.074400     -0.1843000      -2.961000    
 H   -7.003100      0.8289000     -4.0500000E-02
 H   -6.033900       1.670100       1.213500    
 H   -7.468000      0.7253000       1.672000    


%chk=000158325-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158325

0 1
O 0.058813 -0.363406 0.071062
O 6.091880 -0.439156 -1.100525
O -5.887366 -0.177667 1.319744
O 6.276901 -1.496475 1.353508
O -6.174533 -1.438715 -1.272512
C 0.838980 1.925563 0.163027
C -0.712566 1.931886 0.121942
C 1.174415 0.509876 -0.391971
C -1.054799 0.483421 0.583688
C 1.514481 3.066301 -0.613756
C -1.378853 3.025631 0.970991
C 2.506534 -0.060914 0.056734
C -2.386207 -0.049754 0.086233
C 3.632954 0.020078 -0.803597
C -3.552089 0.108413 0.870296
C 2.655843 -0.636943 1.340333
C -2.496990 -0.667291 -1.182390
C 4.884052 -0.451560 -0.364498
C -4.819805 -0.321591 0.417319
C 3.909971 -1.118046 1.777137
C -3.751809 -1.113220 -1.644022
C 5.029458 -1.022048 0.931340
C -4.914537 -0.954635 -0.855194
C 6.052303 0.102462 -2.457935
C -7.168638 0.348728 0.806120
H 1.161996 1.960973 1.224360
H -1.035438 2.036848 -0.935184
H 1.142797 0.550904 -1.504090
H -1.031622 0.449508 1.695117
H 1.190359 3.070187 -1.672639
H 1.262676 4.050245 -0.178607
H 2.614843 2.962866 -0.590672
H -1.114155 4.033287 0.602606
H -2.480030 2.937208 0.940272
H -1.058607 2.955492 2.028410
H 3.516182 0.443560 -1.807651
H -3.507542 0.562196 1.867045
H 1.774366 -0.739481 1.980483
H -1.593883 -0.830099 -1.777268
H 4.036883 -1.575412 2.762865
H -3.830555 -1.613221 -2.619556
H 6.929528 -1.351158 0.617846
H -6.084736 -1.921195 -2.131440
H 7.079914 0.016191 -2.840463
H 5.743251 1.165641 -2.451588
H 5.363791 -0.482067 -3.098128
H -7.608495 -0.331358 0.059548
H -7.022164 1.352354 0.360945
H -7.815148 0.425295 1.693714


