%chk=000052412.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052412

0 1
 O    4.046700      4.4100001E-02 -9.6199997E-02
 O    1.504200       1.063500      -1.956900    
 O    3.235400      8.0700003E-02   2.060100    
 C  -0.7491000      1.5300000E-02  0.5338000    
 C   -1.421400       1.229600      0.3166000    
 C   -1.389600      -1.220200      0.3416000    
 C   -2.769300       1.207900     -0.1039000    
 C   -2.737500      -1.242000     -7.9000004E-02
 C   -3.409800     -2.7700000E-02 -0.2963000    
 C   0.6546000      3.7799999E-02  0.9703000    
 C  -0.7817000       2.465500      0.5086000    
 C  -0.7182000      -2.434900      0.5587000    
 C   -3.440900       2.422600     -0.3207000    
 C   -3.377300      -2.477900     -0.2712000    
 C   -1.462900       3.662800      0.2888000    
 C   -1.368200      -3.653600      0.3634000    
 C   -2.790900       3.641400     -0.1253000    
 C   -2.696100      -3.675100     -5.1100001E-02
 C    1.740300      4.0899999E-02  0.1748000    
 C    1.589800      2.0199999E-02  -1.311900    
 C    3.068600      6.4300001E-02  0.8493000    
 C    1.535900      -1.325800      -1.985900    
 C    5.388700      4.2100001E-02  0.4013000    
 C    6.348600      1.8700000E-02 -0.7690000    
 H   -4.450200     -4.4500001E-02 -0.6209000    
 H   0.7607000      5.2400000E-02   2.053800    
 H   0.2519000       2.542500      0.8362000    
 H   0.3156000      -2.478900      0.8912000    
 H   -4.479600       2.429600     -0.6447000    
 H   -4.415200      -2.518300     -0.5950000    
 H  -0.9570000       4.611600      0.4421000    
 H  -0.8380000      -4.585600      0.5365000    
 H   -3.322200       4.573000     -0.2964000    
 H   -3.202900      -4.623600     -0.2029000    
 H    2.251100      -1.339200      -2.813000    
 H   0.5257000      -1.504200      -2.361800    
 H    1.808700      -2.124100      -1.290600    
 H    5.557200      0.9439000       1.000400    
 H    5.545000     -0.8443000       1.026100    
 H    7.386300      1.6400000E-02 -0.4240000    
 H    6.179400     -0.8685000      -1.388100    
 H    6.191800      0.8902000      -1.413300    


%chk=000052412-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052412

0 1
O 4.196310 0.005079 -0.024149
O 2.276840 1.916648 -1.306665
O 3.303545 -0.491527 2.073975
C -0.714500 -0.235015 0.454232
C -1.328945 1.016258 0.102938
C -1.497687 -1.440235 0.475368
C -2.738716 1.035164 -0.284743
C -2.905648 -1.398256 0.100882
C -3.484643 -0.165992 -0.282661
C 0.703279 -0.331771 0.866770
C -0.637563 2.280525 0.172203
C -0.932830 -2.720492 0.824289
C -3.359259 2.286144 -0.642164
C -3.678901 -2.613775 0.114396
C -1.274174 3.470476 -0.168254
C -1.711631 -3.875414 0.836037
C -2.645658 3.477365 -0.594761
C -3.101800 -3.825207 0.478755
C 1.826698 0.085594 0.199273
C 1.841206 0.742425 -1.171381
C 3.143323 -0.149003 0.875077
C 1.348183 -0.089919 -2.341330
C 5.571448 -0.184105 0.531025
C 6.544227 0.055418 -0.618212
H -4.541796 -0.139033 -0.576071
H 0.897111 -0.816642 1.837320
H 0.401676 2.309663 0.507764
H 0.130614 -2.788189 1.074751
H -4.413974 2.278329 -0.941753
H -4.736283 -2.563795 -0.171386
H -0.722215 4.414424 -0.108951
H -1.261600 -4.834896 1.113673
H -3.124883 4.424224 -0.865643
H -3.697487 -4.744227 0.489003
H 1.330989 0.516926 -3.259856
H 0.341890 -0.499315 -2.138569
H 2.025834 -0.953928 -2.482984
H 5.707649 0.533832 1.359862
H 5.640912 -1.206380 0.945698
H 7.582926 -0.056015 -0.257143
H 6.380375 -0.669417 -1.433913
H 6.423359 1.072657 -1.027205


