%chk=000044284.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044284

0 1
 O    4.256900       1.957900     -6.9999998E-04
 C   0.1559000     -0.7040000      1.9999999E-04
 C  -0.6288000      0.4864000      1.9999999E-04
 C    1.599200     -0.6352000      1.9999999E-04
 C   -2.072100      0.4176000      1.9999999E-04
 C    2.231800      0.6309000     -1.9999999E-04
 C   -2.704900     -0.8485000     -3.0000001E-04
 C   6.6000000E-02   1.712900      1.9999999E-04
 C  -0.5390000      -1.930600       0.000000    
 C    1.457200       1.786100     -1.9999999E-04
 C   -1.930200      -2.003700     -3.9999999E-04
 C    2.460600      -1.764400      5.0000002E-04
 C   -2.933600       1.546900      6.9999998E-04
 C    3.633700      0.7409000     -9.9999997E-05
 C   -4.106700     -0.9583000     -5.0000002E-04
 C    3.853900      -1.645700      3.9999999E-04
 C    4.441100     -0.3912000       0.000000    
 C   -4.326800       1.428300      3.0000001E-04
 C   -4.914100      0.1737000     -1.9999999E-04
 H  -0.4622000       2.662900      1.9999999E-04
 H  -1.0900000E-02  -2.880700       0.000000    
 H    1.909900       2.775600     -3.9999999E-04
 H   -2.396400      -2.987500     -6.9999998E-04
 H    2.063100      -2.775900      7.9999998E-04
 H   -2.536100       2.558400      1.1000000E-03
 H   -4.585100      -1.936200     -8.9999998E-04
 H    4.473300      -2.537900      5.0000002E-04
 H    5.524400     -0.3099000       0.000000    
 H   -4.946300       2.320300      6.0000003E-04
 H   -5.995000      7.4299999E-02 -3.9999999E-04
 H    5.220600       1.828100     -6.9999998E-04


%chk=000044284-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000044284

0 1
O 4.228546 2.027518 0.000007
C 0.156455 -0.715066 -0.000013
C -0.623538 0.490097 0.000004
C 1.617703 -0.645138 0.000022
C -2.084902 0.413930 0.000018
C 2.249821 0.651681 0.000029
C -2.725773 -0.880614 -0.000052
C 0.061029 1.758570 0.000005
C -0.528153 -1.985009 -0.000087
C 1.443389 1.840727 0.000003
C -1.909692 -2.066482 -0.000116
C 2.450828 -1.810640 0.000059
C -2.925701 1.572954 0.000111
C 3.682628 0.731222 0.000048
C -4.153188 -0.970981 -0.000054
C 3.845302 -1.696553 0.000076
C 4.477319 -0.421820 0.000069
C -4.321840 1.462735 0.000099
C -4.946045 0.180442 0.000014
H -0.517472 2.686175 -0.000014
H 0.052648 -2.911232 -0.000140
H 1.949316 2.809814 -0.000017
H -2.405579 -3.044491 -0.000190
H 2.007916 -2.809577 0.000073
H -2.482053 2.572816 0.000190
H -4.616999 -1.964737 -0.000122
H 4.465694 -2.599286 0.000100
H 5.572408 -0.347279 0.000068
H -4.939013 2.368115 0.000167
H -6.038720 0.102417 -0.000003
H 5.217064 1.991193 0.000046


