A1I3H
  CCTOOLS-0116261006

 20 20  0  0  0  0  0  0  0  0999 V2000
    2.7430    0.0020   -0.4640 C   0  0  0  0  0
    1.2450    0.0020    1.5380 C   0  0  0  0  0
    1.2880    0.0020    0.0090 C   0  0  0  0  0
    0.5730   -1.2460   -0.5260 C   0  0  0  0  0
   -0.8970   -1.1410   -0.1860 C   0  0  0  0  0
   -1.4730   -2.0470    0.3670 O   0  0  0  0  0
   -1.5490   -0.0020   -0.5180 O   0  0  0  0  0
   -0.9000    1.1390   -0.1860 C   0  0  0  0  0
   -1.4780    2.0450    0.3670 O   0  0  0  0  0
    0.5700    1.2480   -0.5260 C   0  0  0  0  0
    3.2470   -0.8890   -0.0880 H   0  0  0  0  0
    2.7710    0.0020   -1.5540 H   0  0  0  0  0
    3.2480    0.8910   -0.0880 H   0  0  0  0  0
    1.7440   -0.8910    1.9150 H   0  0  0  0  0
    1.7540    0.8890    1.9160 H   0  0  0  0  0
    0.2080    0.0070    1.8720 H   0  0  0  0  0
    0.6950   -1.3020   -1.6080 H   0  0  0  0  0
    0.9940   -2.1370   -0.0600 H   0  0  0  0  0
    0.9890    2.1400   -0.0600 H   0  0  0  0  0
    0.6920    1.3050   -1.6080 H   0  0  0  0  0
  1 11  1  0  0  0
  1 12  1  0  0  0
  1 13  1  0  0  0
  2  3  1  0  0  0
  2 14  1  0  0  0
  2 15  1  0  0  0
  2 16  1  0  0  0
  3  4  1  0  0  0
  3  1  1  0  0  0
  4  5  1  0  0  0
  4 17  1  0  0  0
  4 18  1  0  0  0
  5  7  1  0  0  0
  5  6  2  0  0  0
  8  9  2  0  0  0
  8  7  1  0  0  0
 10  3  1  0  0  0
 10  8  1  0  0  0
 10 19  1  0  0  0
 10 20  1  0  0  0
M  END
$$$$
