A1I0J
  CCTOOLS-0710261011

 40 40  0  0  1  0  0  0  0  0999 V2000
    4.0430   -0.3630   -2.0000 O   0  0  0  0  0
    3.9400   -0.3210   -0.3940 P   0  0  0  0  0
    4.2410   -1.6610    0.1550 O   0  0  0  0  0
    4.9980    0.7470    0.1840 O   0  0  0  0  0
    2.4500    0.1130    0.0370 O   0  0  0  0  0
    2.0110    0.1420    1.3960 C   0  0  0  0  0
    0.5510    0.5970    1.4510 C   0  0  0  0  0
    0.4090    1.9420    0.7350 C   0  0  0  0  0
    0.9220    1.8300   -0.5940 O   0  0  0  0  0
   -0.2750   -0.3750    0.8070 O   0  0  0  0  0
   -1.6000   -0.4540    1.3360 C   0  0  0  0  0
   -2.3250    0.7270    0.9860 O   0  0  0  0  0
   -2.4240    0.9540   -0.4220 C   0  0  0  0  0
   -3.1900    2.2530   -0.6760 C   0  0  0  0  0
   -2.4390    3.3570   -0.1670 O   0  0  0  0  0
   -3.1670   -0.2140   -1.0750 C   0  0  0  0  0
   -4.4960   -0.2850   -0.5540 O   0  0  0  0  0
   -2.4260   -1.5180   -0.7650 C   0  0  0  0  0
   -3.1510   -2.6220   -1.3110 O   0  0  0  0  0
   -2.3100   -1.6790    0.7540 C   0  0  0  0  0
   -1.5570   -2.8550    1.0540 O   0  0  0  0  0
    4.9150   -0.6180   -2.3320 H   0  0  0  0  0
    4.8600    1.6490   -0.1350 H   0  0  0  0  0
    2.0970   -0.8550    1.8280 H   0  0  0  0  0
    2.6290    0.8380    1.9640 H   0  0  0  0  0
    0.2420    0.7050    2.4910 H   0  0  0  0  0
   -0.6440    2.2230    0.6960 H   0  0  0  0  0
    0.9680    2.7030    1.2770 H   0  0  0  0  0
    0.8630    2.6470   -1.1080 H   0  0  0  0  0
   -1.5530   -0.5430    2.4220 H   0  0  0  0  0
   -1.4240    1.0330   -0.8490 H   0  0  0  0  0
   -3.3430    2.3810   -1.7480 H   0  0  0  0  0
   -4.1570    2.2090   -0.1740 H   0  0  0  0  0
   -2.8660    4.2160   -0.2940 H   0  0  0  0  0
   -3.2050   -0.0640   -2.1540 H   0  0  0  0  0
   -5.0240   -1.0070   -0.9220 H   0  0  0  0  0
   -1.4290   -1.4840   -1.2050 H   0  0  0  0  0
   -2.7380   -3.4810   -1.1510 H   0  0  0  0  0
   -3.3070   -1.7640    1.1880 H   0  0  0  0  0
   -1.4450   -3.0200    2.0000 H   0  0  0  0  0
  1  2  1  0  0  0
  1 22  1  0  0  0
  2  4  1  0  0  0
  3  2  2  0  0  0
  4 23  1  0  0  0
  5  6  1  0  0  0
  5  2  1  0  0  0
  6  7  1  0  0  0
  6 24  1  0  0  0
  6 25  1  0  0  0
  7  8  1  0  0  0
  7 26  1  0  0  0
  8 27  1  0  0  0
  8 28  1  0  0  0
  9  8  1  0  0  0
  9 29  1  0  0  0
 10  7  1  0  0  0
 11 10  1  0  0  0
 11 30  1  0  0  0
 12 13  1  0  0  0
 12 11  1  0  0  0
 13 31  1  0  0  0
 14 13  1  0  0  0
 14 15  1  0  0  0
 14 32  1  0  0  0
 14 33  1  0  0  0
 15 34  1  0  0  0
 16 18  1  0  0  0
 16 13  1  0  0  0
 16 35  1  0  0  0
 17 16  1  0  0  0
 17 36  1  0  0  0
 18 37  1  0  0  0
 19 18  1  0  0  0
 19 38  1  0  0  0
 20 18  1  0  0  0
 20 21  1  0  0  0
 20 11  1  0  0  0
 20 39  1  0  0  0
 21 40  1  0  0  0
M  END
$$$$
