%chk=000023692.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023692

0 1
 O   -2.222000      -2.724200       0.000000    
 C    1.201700      0.2334000      1.9999999E-04
 C   0.3240000     -0.8805000      3.9999999E-04
 C   -1.045700     -0.5981000      3.0000001E-04
 C   -1.557500      0.7124000      3.9999999E-04
 C    2.605200      2.4300000E-02  9.9999997E-05
 C   0.6902000       1.565400      3.0000001E-04
 C   -3.003800      0.6734000      9.9999997E-05
 C  -0.6956000       1.794700      3.9999999E-04
 C    3.129000      -1.289900      9.9999997E-05
 C   -3.428000     -0.6622000     -3.0000001E-04
 C    3.488400       1.130200     -1.9999999E-04
 C   -2.221700      -1.512500       0.000000    
 C   0.8680000      -2.178300      3.9999999E-04
 C    1.585000       2.641900       0.000000    
 C    2.249100      -2.377500      3.9999999E-04
 C    2.963800       2.428200     -3.9999999E-04
 C   -3.944900       1.688600      3.9999999E-04
 C    4.518500      -1.480200     -1.9999999E-04
 C    4.873300      0.9079000     -5.0000002E-04
 C   -4.757300      -1.036100     -7.9999998E-04
 C    5.383600     -0.3883000     -5.0000002E-04
 C   -5.300900       1.338200      9.9999997E-05
 C   -5.702400     -1.0600000E-02 -6.0000003E-04
 H   -1.088400       2.808300      3.9999999E-04
 H   0.2290000      -3.056600      5.0000002E-04
 H    1.218400       3.666700       0.000000    
 H    2.629200      -3.397200      3.9999999E-04
 H    3.625300       3.292300     -6.0000003E-04
 H   -3.654600       2.733900      7.9999998E-04
 H    4.940600      -2.483000     -9.9999997E-05
 H    5.568800       1.744600     -8.9999998E-04
 H   -5.061200      -2.076100     -1.2000001E-03
 H    6.458000     -0.5479000     -7.9999998E-04
 H   -6.056500       2.119700      3.0000001E-04
 H   -6.761800     -0.2532000     -8.9999998E-04


%chk=000023692-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023692

0 1
O -2.208987 -2.820390 -0.000062
C 1.228503 0.256229 -0.000078
C 0.320437 -0.875320 -0.000069
C -1.070379 -0.604072 -0.000052
C -1.571177 0.737007 -0.000039
C 2.646721 0.034279 -0.000093
C 0.710561 1.606719 -0.000061
C -3.058077 0.687311 -0.000025
C -0.701011 1.831383 -0.000045
C 3.167880 -1.311753 -0.000102
C -3.459634 -0.680412 -0.000035
C 3.558531 1.153017 -0.000087
C -2.231581 -1.553255 -0.000055
C 0.866976 -2.215483 -0.000086
C 1.645319 2.707658 -0.000064
C 2.235885 -2.418932 -0.000096
C 3.013679 2.490810 -0.000080
C -4.026273 1.706291 -0.000003
C 4.574387 -1.510251 -0.000114
C 4.960450 0.908523 -0.000094
C -4.812237 -1.052172 -0.000003
C 5.460206 -0.409805 -0.000109
C -5.398578 1.337082 0.000029
C -5.790698 -0.024172 0.000025
H -1.078373 2.860411 -0.000040
H 0.164977 -3.054289 -0.000096
H 1.247213 3.729063 -0.000046
H 2.639472 -3.438552 -0.000105
H 3.709079 3.338472 -0.000070
H -3.742035 2.764469 -0.000001
H 4.968407 -2.533152 -0.000127
H 5.651426 1.759741 -0.000092
H -5.093578 -2.110419 -0.000001
H 6.541778 -0.582048 -0.000118
H -6.166946 2.118489 0.000047
H -6.855525 -0.280777 0.000048


