%chk=000054479.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054479

0 1
 O   -6.067000     -0.2344000      5.0000002E-04
 O    5.964700      0.7348000      9.9999997E-05
 C   0.3799000     -9.7800002E-02 -9.9999997E-05
 C  -0.6092000      0.9190000       0.000000    
 C  -8.4700003E-02  -1.435900     -1.9999999E-04
 C    1.798900      0.1533000       0.000000    
 C   -1.990100      0.6434000       0.000000    
 C   -2.421900     -0.6952000     -9.9999997E-05
 C    2.697000     -0.9459000       0.000000    
 C   -1.462400      -1.716500     -1.9999999E-04
 C   0.8305000      -2.492000     -1.9999999E-04
 C    2.200200      -2.251100       0.000000    
 C  -0.2865000       2.385800     -8.9999998E-04
 C    2.379300       1.446700       0.000000    
 C   -2.947900       1.672300       0.000000    
 C   -3.798700     -0.9773000     -9.9999997E-05
 C    4.086600     -0.7355000      1.9999999E-04
 C   -4.737100      5.4600000E-02   0.000000    
 C   -4.311900       1.378800      3.0000001E-04
 C    3.763200       1.642400      3.0000001E-04
 C    4.617100      0.5506000      3.0000001E-04
 H   -1.796200      -2.754800     -3.0000001E-04
 H   0.4869000      -3.524900     -1.9999999E-04
 H    2.876600      -3.103900       0.000000    
 H   0.2417000       2.636700      0.9259000    
 H   0.2452000       2.634100     -0.9264000    
 H   -1.066500       3.137600     -4.8000002E-03
 H    1.885700       2.395300      1.3000000E-03
 H   -2.763100       2.735500      1.3000000E-03
 H   -4.145800      -2.009100     -9.9999997E-05
 H    4.763200      -1.589200      1.9999999E-04
 H   -5.033100       2.192000      7.9999998E-04
 H    4.165700       2.652200      5.0000002E-04
 H   -6.570500      0.5978000      6.0000003E-04
 H    6.402600     -0.1336000      9.9999997E-05


%chk=000054479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054479

0 1
O -6.184987 -0.422647 0.002940
O 6.136309 0.656906 0.002201
C 0.368961 0.024073 -0.000540
C -0.632551 1.057651 -0.001849
C -0.106034 -1.364304 -0.000486
C 1.848314 0.221287 0.000403
C -2.042419 0.720740 -0.000624
C -2.470534 -0.671411 0.000344
C 2.721781 -0.940161 -0.000959
C -1.476316 -1.674391 -0.000125
C 0.820103 -2.477325 -0.001346
C 2.176093 -2.280295 -0.002083
C -0.269070 2.535359 -0.005615
C 2.531909 1.484185 0.003468
C -3.099765 1.702705 0.000052
C -3.860681 -1.021329 0.001401
C 4.140005 -0.806558 -0.000584
C -4.834957 -0.030260 0.001826
C -4.447462 1.349603 0.001288
C 3.928186 1.609895 0.004077
C 4.746555 0.456618 0.001701
H -1.780001 -2.728272 -0.000112
H 0.400854 -3.490073 -0.001627
H 2.869926 -3.128907 -0.002972
H 0.315457 2.810671 0.891104
H 0.322410 2.803859 -0.899766
H -1.152208 3.185550 -0.011661
H 1.982066 2.417654 0.006069
H -2.870480 2.769978 0.000064
H -4.159865 -2.074000 0.001957
H 4.750847 -1.719623 -0.001832
H -5.216298 2.133764 0.001945
H 4.400425 2.596549 0.006484
H -6.782603 0.365377 0.003079
H 6.618430 -0.207070 0.000579


