%chk=000018299.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018299

0 1
 O    2.214900       2.848300      9.9999997E-05
 O   -2.019500      -3.414500     -1.9999999E-04
 C  -0.3346000      0.2984000      1.9999999E-04
 C   -1.739500      0.1764000      9.9999997E-05
 C   0.5412000     -0.9000000      3.9999999E-04
 C   0.2445000       1.574000      1.9999999E-04
 C    2.027400     -0.7671000      1.9999999E-04
 C   -2.365500      -1.078700      9.9999997E-05
 C   -2.551600       1.336800     -9.9999997E-05
 C    2.585200      0.5250000      9.9999997E-05
 C    1.716800       1.728300      6.0000003E-04
 C  -5.4499999E-02  -2.108500      6.0000003E-04
 C  -0.5579000       2.719200     -1.9999999E-04
 C   -1.528800      -2.292300      9.9999997E-05
 C   -1.945800       2.598900     -3.0000001E-04
 C   -3.759000      -1.198200     -1.9999999E-04
 C   -3.949800       1.206900     -1.9999999E-04
 C    2.915500      -1.858400     -3.0000001E-04
 C    3.976700      0.7125000     -9.9999997E-05
 C   -4.547800     -5.2400000E-02 -1.9999999E-04
 C    4.301000      -1.669200     -5.0000002E-04
 C    4.831000     -0.3854000     -3.9999999E-04
 H   0.4958000      -3.042300      7.9999998E-04
 H  -0.1233000       3.715200     -3.0000001E-04
 H   -2.549600       3.503900     -6.0000003E-04
 H   -4.243400      -2.170600     -1.9999999E-04
 H   -4.587500       2.088500     -3.9999999E-04
 H    2.563800      -2.885700     -3.0000001E-04
 H    4.413400       1.707800       0.000000    
 H   -5.630500     -0.1383000     -3.0000001E-04
 H    4.963800      -2.529900     -6.9999998E-04
 H    5.906900     -0.2394000     -6.0000003E-04


%chk=000018299-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018299

0 1
O 2.263478 2.954578 -0.000083
O -2.026962 -3.524360 0.000152
C -0.301558 0.303650 -0.000037
C -1.738247 0.173949 -0.000071
C 0.539990 -0.903309 0.000028
C 0.270648 1.598734 -0.000059
C 2.016204 -0.746053 -0.000025
C -2.366432 -1.115898 -0.000028
C -2.567120 1.355968 -0.000142
C 2.598545 0.560540 -0.000037
C 1.750960 1.786609 0.000038
C -0.067991 -2.149354 0.000084
C -0.557989 2.765655 -0.000127
C -1.523161 -2.347113 0.000042
C -1.943623 2.650088 -0.000172
C -3.768648 -1.222888 -0.000050
C -3.991808 1.210840 -0.000165
C 2.893969 -1.865722 -0.000129
C 4.007418 0.723058 -0.000096
C -4.584372 -0.058634 -0.000117
C 4.291207 -1.696872 -0.000182
C 4.856752 -0.396579 -0.000158
H 0.512170 -3.076839 0.000149
H -0.058027 3.738670 -0.000127
H -2.577809 3.543992 -0.000221
H -4.206926 -2.226580 -0.000009
H -4.613940 2.113601 -0.000220
H 2.490018 -2.881940 -0.000171
H 4.400858 1.744399 -0.000084
H -5.674632 -0.157724 -0.000134
H 4.942345 -2.577789 -0.000248
H 5.943982 -0.267475 -0.000199


