%chk=000040816.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040816

0 1
 O    1.456000     -8.0600001E-02  -2.511800    
 O   -1.455300     -0.7973000     -0.6019000    
 O   -1.017900     -0.9499000      -2.865100    
 C   0.6523000     -0.1137000      -1.347900    
 C   0.5576000       1.251100     -0.6864000    
 C    1.342300     -0.9368000     -0.2700000    
 C    1.122200       1.207100      0.6090000    
 C    1.603400     -0.1341000      0.8643000    
 C  -0.6879000     -0.6669000      -1.721400    
 C   2.2800000E-02   2.423200      -1.197500    
 C    1.703200      -2.274500     -0.3016000    
 C    1.149900       2.340800       1.404900    
 C    2.229100     -0.6698000       1.978300    
 C   5.1500000E-02   3.564900     -0.3950000    
 C    2.333300      -2.813300      0.8214000    
 C   0.6089000       3.524100      0.8937000    
 C    2.593600      -2.019000       1.950200    
 C   -2.770900      -1.318500     -0.8156000    
 C   -3.490700      -1.400500      0.5230000    
 C   -3.623000     -2.8000001E-02   1.176800    
 C   -4.380300     -0.1082000       2.492500    
 H  -0.4089000       2.459100      -2.191800    
 H    1.504300      -2.891000      -1.171400    
 H    1.578500       2.325800       2.401400    
 H    2.437500     -6.9200002E-02   2.857500    
 H    1.172100      0.6684000      -3.063000    
 H  -0.3620000       4.497300     -0.7700000    
 H    2.626800      -3.859700      0.8240000    
 H   0.6199000       4.425900       1.500300    
 H    3.085600      -2.460700       2.812900    
 H   -2.696600      -2.320400      -1.253600    
 H   -3.318500     -0.6638000      -1.503400    
 H   -2.929400      -2.060500       1.195800    
 H   -4.482100      -1.843400      0.3738000    
 H   -4.149800      0.6568000      0.5019000    
 H   -2.632900      0.4027000       1.365800    
 H   -5.391600     -0.4986000       2.340300    
 H   -3.863100     -0.7603000       3.203600    
 H   -4.464300      0.8859000       2.942700    


%chk=000040816-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040816

0 1
O 1.484826 -0.016633 -2.607099
O -1.483735 -0.766804 -0.600140
O -1.010229 -0.924239 -2.873465
C 0.732718 -0.068966 -1.359299
C 0.617329 1.300928 -0.668588
C 1.429261 -0.913918 -0.280773
C 1.135561 1.230652 0.655199
C 1.637403 -0.139688 0.895304
C -0.675646 -0.632928 -1.694097
C 0.114036 2.498966 -1.192069
C 1.854961 -2.246146 -0.361005
C 1.128863 2.374481 1.479563
C 2.259347 -0.715886 2.021764
C 0.114611 3.652313 -0.365655
C 2.487720 -2.824368 0.769534
C 0.612166 3.586202 0.959042
C 2.680932 -2.066103 1.950475
C -2.869460 -1.301957 -0.838858
C -3.557659 -1.367807 0.522468
C -3.770766 0.015271 1.179225
C -4.462920 -0.089801 2.554327
H -0.258738 2.550230 -2.220967
H 1.716596 -2.825881 -1.280160
H 1.520905 2.336091 2.502106
H 2.423254 -0.134147 2.935856
H 0.866823 -0.331413 -3.328047
H -0.267873 4.602312 -0.754957
H 2.834091 -3.862981 0.728912
H 0.604081 4.485971 1.584576
H 3.170159 -2.528370 2.815303
H -2.769482 -2.292594 -1.317818
H -3.379885 -0.616623 -1.540708
H -2.964909 -2.016495 1.196131
H -4.537554 -1.867897 0.376947
H -4.378296 0.650860 0.502861
H -2.790766 0.516568 1.288740
H -5.456494 -0.569934 2.468721
H -3.857406 -0.692845 3.256882
H -4.608226 0.907978 3.006467


