%chk=000054577.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054577

0 1
 O   -2.802700       2.067200      0.6030000    
 O   -4.009900      3.4000000E-03   1.809900    
 O   -3.693900      -1.493700      -1.500400    
 C   -3.667800       1.259400     -0.2031000    
 C   -2.208200       1.443600     -0.5450000    
 C   -4.108400     -4.5400001E-02  0.3876000    
 C   -1.251700      0.2983000     -0.2872000    
 C   -3.287300      -1.227400     -0.1578000    
 C   -1.787900     -0.9966000     -0.1097000    
 C   0.1625000      0.4814000     -0.2188000    
 C  -0.9379000      -2.081300      8.7600000E-02
 C    1.037000     -0.6221000     -4.9999999E-03
 C   0.4414000      -1.894500      0.1383000    
 C   0.7302000       1.758500     -0.3583000    
 C    2.463600     -0.4139000      5.5900000E-02
 C    2.978900      0.8974000     -9.4700001E-02
 C    2.105800       1.963800     -0.2983000    
 C    3.417500      -1.444600      0.2609000    
 C    4.362600       1.139400     -4.0399998E-02
 C    4.791700      -1.193100      0.3131000    
 C    5.264600      0.1003000      0.1624000    
 H   -4.415300       1.751300     -0.8091000    
 H   -2.010100       2.072900      -1.407700    
 H   -5.168400     -0.1873000      0.1456000    
 H   -3.521000      -2.119200      0.4379000    
 H   -1.340200      -3.084100      0.2083000    
 H   -4.343400     -0.8418000       2.156300    
 H    1.042900      -2.785200      0.2995000    
 H   0.1068000       2.636500     -0.5150000    
 H   -4.642300      -1.708000      -1.483300    
 H    2.483300       2.978300     -0.4138000    
 H    3.109600      -2.479500      0.3862000    
 H    4.752700       2.149100     -0.1566000    
 H    5.486700      -2.012600      0.4721000    
 H    6.330500      0.3021000      0.2021000    


%chk=000054577-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054577

0 1
O -2.762751 2.123350 0.673001
O -4.098675 0.008173 1.857069
O -3.617597 -1.439665 -1.601312
C -3.648612 1.264180 -0.183628
C -2.207269 1.396757 -0.560437
C -4.148050 -0.066078 0.394877
C -1.272898 0.268355 -0.281659
C -3.305011 -1.246936 -0.161288
C -1.810366 -1.016758 -0.075999
C 0.145789 0.482638 -0.218345
C -0.936365 -2.108379 0.169743
C 1.030109 -0.634559 0.013263
C 0.449789 -1.924552 0.205725
C 0.707027 1.808320 -0.369600
C 2.479411 -0.414546 0.055724
C 2.991677 0.922363 -0.118235
C 2.071113 2.016889 -0.321005
C 3.421025 -1.470067 0.261542
C 4.401186 1.155272 -0.079691
C 4.800354 -1.221910 0.294971
C 5.299039 0.101377 0.123628
H -4.390193 1.843458 -0.746175
H -1.948876 2.084685 -1.374541
H -5.198384 -0.218519 0.054047
H -3.568697 -2.170963 0.401830
H -1.359139 -3.109049 0.317236
H -4.406070 -0.859548 2.227525
H 1.089685 -2.791745 0.390784
H 0.032359 2.660162 -0.495770
H -4.567350 -1.717171 -1.689903
H 2.481078 3.028042 -0.429224
H 3.071909 -2.498430 0.394724
H 4.769742 2.179480 -0.211711
H 5.499062 -2.050721 0.453494
H 6.377850 0.288693 0.151837


