KAY
  CCTOOLS-0919241041

 21 21  0  0  0  0  0  0  0  0999 V2000
   -0.7840    1.6560    0.0970 C   0  0  0  0  0
    1.5590    0.8160    0.0580 C   0  0  0  0  0
    3.9460    0.0720    0.0330 C   0  0  0  0  0
    2.4680   -0.2230   -0.0040 C   0  0  0  0  0
    2.0310   -1.5320   -0.0990 C   0  0  0  0  0
    0.6780   -1.8170   -0.1330 C   0  0  0  0  0
   -0.2530   -0.7830   -0.0720 C   0  0  0  0  0
   -1.7000   -1.0840   -0.1020 C   0  0  0  0  0
    0.1920    0.5480    0.0310 C   0  0  0  0  0
   -2.4130   -0.5520   -0.9290 O   0  0  0  0  0
   -2.2280   -1.9470    0.7870 O   0  0  0  0  0
   -0.3580    2.9330    0.0560 O   0  0  0  0  0
   -1.9710    1.4140    0.1840 O   0  0  0  0  0
    1.9070    1.8360    0.1330 H   0  0  0  0  0
    4.2910    0.0720    1.0670 H   0  0  0  0  0
    4.4830   -0.6920   -0.5300 H   0  0  0  0  0
    4.1320    1.0500   -0.4120 H   0  0  0  0  0
    2.7500   -2.3360   -0.1480 H   0  0  0  0  0
    0.3440   -2.8410   -0.2080 H   0  0  0  0  0
   -3.1790   -2.1120    0.7280 H   0  0  0  0  0
   -1.0340    3.6230    0.1030 H   0  0  0  0  0
  1  9  1  0  0  0
  1 12  1  0  0  0
  2  4  2  0  0  0
  2 14  1  0  0  0
  3 15  1  0  0  0
  3 16  1  0  0  0
  3 17  1  0  0  0
  4  3  1  0  0  0
  5  4  1  0  0  0
  5 18  1  0  0  0
  6  5  2  0  0  0
  6 19  1  0  0  0
  7  9  2  0  0  0
  7  6  1  0  0  0
  8 11  1  0  0  0
  8  7  1  0  0  0
  9  2  1  0  0  0
 10  8  2  0  0  0
 11 20  1  0  0  0
 12 21  1  0  0  0
 13  1  2  0  0  0
M  END
$$$$