%chk=000008834.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008834

0 1
 O    1.247000      -1.664500      0.3809000    
 O    2.314100     -0.5431000      -1.330100    
 C   -1.692600      -1.342500      0.4320000    
 C   -2.951400     -0.5003000      0.1191000    
 C  -0.8216000      -1.550000     -0.8212000    
 C   -2.693400      0.8599000     -0.5454000    
 C   -2.130900      -2.681500       1.038200    
 C   0.4449000      -2.360200     -0.5656000    
 C   -1.890100       1.787800      0.3228000    
 C  -0.7440000       2.429000      2.5400000E-02
 C    2.150400     -0.7763000     -0.1404000    
 C  -0.1103000       2.260200      -1.330600    
 C   9.1000004E-03   3.346300      0.9462000    
 C    2.916000     -0.1260000      0.9879000    
 C    3.952800      0.8612000      0.4810000    
 H   -1.105900     -0.8096000       1.190700    
 H   -3.613700      -1.076800     -0.5404000    
 H   -3.513100     -0.3410000       1.049400    
 H  -0.5207000     -0.5809000      -1.225600    
 H   -1.411000      -2.052600      -1.597800    
 H   -2.288500      0.7054000      -1.545000    
 H   -3.668200       1.339200     -0.7064000    
 H   -2.624700      -3.313800      0.2926000    
 H   -1.281000      -3.233300       1.450400    
 H   -2.833800      -2.522000       1.863400    
 H   0.2217000      -3.351500     -0.1613000    
 H   0.9867000      -2.532300      -1.503500    
 H   -2.310900       1.957800       1.313500    
 H   7.0400000E-02   3.247400      -1.772000    
 H  -0.6900000       1.705300      -2.066300    
 H   0.8587000       1.763400      -1.226400    
 H   7.4699998E-02   4.351100      0.5169000    
 H    1.023000       2.969300       1.114700    
 H  -0.4831000       3.429700       1.920700    
 H    3.415100     -0.9109000       1.565800    
 H    2.201900      0.3966000       1.633100    
 H    3.481400       1.663800     -9.6000001E-02
 H    4.490700       1.313400       1.319700    
 H    4.682800      0.3664000     -0.1681000    


%chk=000008834-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008834

0 1
O 1.305614 -1.775467 0.330755
O 2.099772 -0.223364 -1.220785
C -1.685582 -1.374464 0.429098
C -2.965465 -0.531273 0.175453
C -0.884576 -1.594460 -0.880076
C -2.737984 0.864308 -0.477301
C -2.059074 -2.709007 1.115932
C 0.424289 -2.382744 -0.717928
C -1.775341 1.736465 0.306201
C -0.684153 2.415608 -0.155175
C 2.071601 -0.671984 -0.050262
C -0.215073 2.429029 -1.600410
C 0.179049 3.234513 0.793799
C 2.824471 -0.111387 1.147484
C 3.954685 0.853348 0.744870
H -1.036230 -0.800840 1.121193
H -3.665154 -1.112994 -0.461873
H -3.479045 -0.386407 1.148925
H -0.643609 -0.619432 -1.338323
H -1.514079 -2.150038 -1.608446
H -2.398614 0.742029 -1.521799
H -3.726513 1.368327 -0.534707
H -2.653400 -3.352756 0.437528
H -1.163989 -3.275221 1.429842
H -2.668003 -2.525680 2.021072
H 0.259125 -3.405867 -0.345118
H 0.984216 -2.409795 -1.670048
H -2.004721 1.815165 1.382229
H -0.066019 3.470598 -1.947467
H -0.925387 1.945223 -2.290757
H 0.759436 1.910972 -1.700273
H 0.188490 4.303791 0.501942
H 1.234394 2.893662 0.762934
H -0.176448 3.167640 1.837264
H 3.200585 -0.956669 1.751493
H 2.079070 0.407282 1.783745
H 3.566132 1.672683 0.116031
H 4.425566 1.290646 1.642900
H 4.734462 0.332662 0.162356


