%chk=000147207.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147207

0 1
 O    2.475800       2.118200      0.4201000    
 O    1.637200       3.101000      -1.568700    
 O    2.327400      -3.294600     -0.3568000    
 O    4.394900      -2.256400      0.3152000    
 O   -2.492500      0.2493000      -1.785300    
 O   -4.743800     -0.7978000     -0.5661000    
 C  -0.1673000       1.011500     -0.3047000    
 C   6.0600001E-02   2.448700      0.1982000    
 C    1.462900       2.952500     -0.1585000    
 C    1.084500      0.1701000     -0.1291000    
 C   -1.418600      0.4334000      0.3433000    
 C    2.315400      0.7707000      0.2218000    
 C    1.673500       4.346100      0.4367000    
 C    1.044500      -1.217600     -0.3634000    
 C    3.469900     -5.0000002E-04  0.4082000    
 C    2.200900      -1.950200     -0.1867000    
 C   -2.519800      8.0499999E-02 -0.4324000    
 C    3.379400      -1.358800      0.1953000    
 C   -1.447100      0.2613000       1.724900    
 C   -3.657600     -0.4479000      0.1777000    
 C   -2.584700     -0.2670000       2.334900    
 C    3.720600      -3.482200     -3.5000000E-02
 C   -3.689900     -0.6217000       1.561300    
 C   -2.660600     -0.9181000      -2.586200    
 C   -5.865600      -1.330400      0.1355000    
 H  -0.3164000       1.073400      -1.390000    
 H  -0.7086000       3.103300     -0.2322000    
 H  -4.8200000E-02   2.497600       1.289300    
 H    1.597600       4.331300       1.529300    
 H    2.673600       4.721200      0.1885000    
 H   0.9506000       5.064900      3.6100000E-02
 H   0.1293000      -1.712900     -0.6708000    
 H    4.410700      0.4574000      0.6956000    
 H  -0.5940000      0.5190000       2.346300    
 H    1.205300       2.360400      -2.022100    
 H   -2.607800     -0.4047000       3.412100    
 H    3.795400      -4.177600      0.8089000    
 H    4.224700      -3.924800     -0.9018000    
 H   -4.537700      -1.026300       2.103200    
 H   -3.705400      -1.013400      -2.894700    
 H   -2.330600      -1.826400      -2.070000    
 H   -2.051400     -0.7984000      -3.487000    
 H   -6.295100     -0.5969000      0.8264000    
 H   -5.620000      -2.276200      0.6305000    
 H   -6.635700      -1.553100     -0.6104000    


%chk=000147207-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000147207

0 1
O 2.407376 2.167950 0.301076
O 1.456678 2.789894 -1.830890
O 2.886841 -3.404355 0.297399
O 4.808747 -2.073429 0.833498
O -2.581086 0.681244 -1.643145
O -4.936546 -0.338940 -0.487887
C -0.097078 0.677062 -0.344418
C -0.046282 2.180556 0.056594
C 1.266180 2.853242 -0.390137
C 1.233232 -0.010567 -0.027618
C -1.322839 0.035764 0.311819
C 2.394566 0.755954 0.273496
C 1.397042 4.319296 -0.005247
C 1.336651 -1.434709 -0.063779
C 3.649386 0.151660 0.572843
C 2.567599 -2.017721 0.217866
C -2.563057 0.054848 -0.379623
C 3.700987 -1.237698 0.538410
C -1.274731 -0.484918 1.630290
C -3.744085 -0.445399 0.251966
C -2.434227 -0.996596 2.241463
C 4.363131 -3.439031 0.443503
C -3.671344 -0.980860 1.557889
C -3.164841 -0.063746 -2.780033
C -6.177097 -0.766353 0.164306
H -0.283679 0.631855 -1.438456
H -0.903495 2.706648 -0.397073
H -0.124361 2.273272 1.155257
H 1.310322 4.437924 1.086888
H 2.381845 4.692573 -0.329587
H 0.610733 4.909836 -0.502974
H 0.456962 -2.046166 -0.282775
H 4.515367 0.775236 0.801929
H -0.317815 -0.500895 2.161851
H 1.309826 1.863033 -2.152249
H -2.385321 -1.406425 3.255812
H 4.628705 -4.143724 1.245755
H 4.820077 -3.698043 -0.531445
H -4.567375 -1.370299 2.049946
H -4.242307 -0.230521 -2.625314
H -2.646302 -1.033191 -2.913010
H -2.990532 0.578470 -3.656954
H -6.365881 -0.181675 1.085064
H -6.155886 -1.846595 0.406747
H -6.969785 -0.566564 -0.571649


