OKE
  CCTOOLS-0919241027

 21 21  0  0  0  0  0  0  0  0999 V2000
    0.0240   -0.7200   -0.0130 C   0  0  0  0  0
    3.6080    0.0620   -0.0050 C   0  0  0  0  0
    1.2320   -0.0290   -0.0060 C   0  0  0  0  0
    1.2340    1.3570    0.0080 C   0  0  0  0  0
    0.0380    2.0500    0.0160 C   0  0  0  0  0
   -1.1620    1.3640    0.0090 C   0  0  0  0  0
   -1.1720   -0.0190   -0.0110 C   0  0  0  0  0
   -2.4820   -0.7630   -0.0180 C   0  0  0  0  0
    2.4070   -0.7120   -0.0130 O   0  0  0  0  0
   -3.5620    0.1730   -0.0000 O   0  0  0  0  0
    0.0160   -2.0790   -0.0260 O   0  0  0  0  0
    4.4710   -0.6040   -0.0120 H   0  0  0  0  0
    3.6350    0.7000   -0.8890 H   0  0  0  0  0
    3.6350    0.6820    0.8910 H   0  0  0  0  0
    2.1700    1.8950    0.0140 H   0  0  0  0  0
    0.0410    3.1300    0.0270 H   0  0  0  0  0
   -2.0950    1.9090    0.0110 H   0  0  0  0  0
   -2.5470   -1.3760   -0.9160 H   0  0  0  0  0
   -2.5410   -1.4020    0.8630 H   0  0  0  0  0
   -4.4380   -0.2370   -0.0030 H   0  0  0  0  0
    0.0140   -2.4810    0.8530 H   0  0  0  0  0
  1 11  1  0  0  0
  1  3  2  0  0  0
  2 12  1  0  0  0
  2 13  1  0  0  0
  2 14  1  0  0  0
  3  9  1  0  0  0
  4  3  1  0  0  0
  4 15  1  0  0  0
  5  4  2  0  0  0
  5 16  1  0  0  0
  6  7  2  0  0  0
  6  5  1  0  0  0
  6 17  1  0  0  0
  7  1  1  0  0  0
  8  7  1  0  0  0
  8 18  1  0  0  0
  8 19  1  0  0  0
  9  2  1  0  0  0
 10  8  1  0  0  0
 10 20  1  0  0  0
 11 21  1  0  0  0
M  END
$$$$