A1JZ3
  CCTOOLS-0807261402

 34 37  0  0  0  0  0  0  0  0999 V2000
    1.5150    0.9560    2.0900 C   0  0  0  0  0
    0.2840   -2.1810    1.0100 C   0  0  0  0  0
    0.3150   -2.8040    2.3780 C   0  0  0  0  0
    2.0440    2.2280    2.6930 C   0  0  0  0  0
   -0.2840    0.3570    0.0690 RH  0  0  0  0  0
    1.9090   -0.3730   -0.3120 RH  0  0  0  0  0
    0.2720    0.7980    2.0350 O   0  5  0  0  0
   -0.7630   -1.5940    0.6480 O   0  5  0  0  0
    1.3120   -2.2820    0.3010 O   0  0  0  0  0
    2.3500    0.1200    1.6730 O   0  0  0  0  0
    3.8660   -1.0240   -0.6500 O   0  5  0  0  0
   -0.5340   -2.6590    2.8230 H   0  0  0  0  0
    1.0230   -2.4020    2.9020 H   0  0  0  0  0
    0.4760   -3.7560    2.2990 H   0  0  0  0  0
    1.3050    2.7880    2.9770 H   0  0  0  0  0
    2.5720    2.7050    2.0350 H   0  0  0  0  0
    2.6000    2.0190    3.4580 H   0  0  0  0  0
    3.8500   -1.8050   -1.0240 H   0  0  0  0  0
   -2.2400    1.0070    0.4090 O   0  5  0  0  0
   -0.7210   -0.1170   -1.9230 O   0  0  0  0  0
    1.3530   -0.8200   -2.2810 O   0  5  0  0  0
    0.3160    2.2660   -0.5280 O   0  0  0  0  0
    2.3870    1.5750   -0.9010 O   0  5  0  0  0
    0.1090   -0.9390   -2.3790 C   0  0  0  0  0
    1.3390    2.1660   -1.2470 C   0  0  0  0  0
    1.3110    2.7920   -2.6140 C   0  0  0  0  0
   -0.4160   -2.1490   -3.1010 C   0  0  0  0  0
   -1.3850   -2.1300   -3.1110 H   0  0  0  0  0
   -0.1170   -2.9530   -2.6490 H   0  0  0  0  0
   -0.0870   -2.1530   -4.0120 H   0  0  0  0  0
    0.4510    3.2150   -2.7640 H   0  0  0  0  0
    1.4520    2.1090   -3.2870 H   0  0  0  0  0
    2.0110    3.4580   -2.6820 H   0  0  0  0  0
   -2.7970    0.4070    0.1280 H   0  0  0  0  0
  1  4  1  0  0  0
  2  3  1  0  0  0
  3 12  1  0  0  0
  3 13  1  0  0  0
  3 14  1  0  0  0
  4 15  1  0  0  0
  4 16  1  0  0  0
  4 17  1  0  0  0
  5  6  2  0  0  0
  5  7  1  0  0  0
  5  8  1  0  0  0
  5 19  1  0  0  0
  5 20  1  0  0  0
  5 22  1  0  0  0
  6  9  1  0  0  0
  6 10  1  0  0  0
  6 11  1  0  0  0
  6 21  1  0  0  0
  6 23  1  0  0  0
  7  1  1  0  0  0
  8  2  1  0  0  0
  9  2  2  0  0  0
 10  1  2  0  0  0
 11 18  1  0  0  0
 19 34  1  0  0  0
 20 24  2  0  0  0
 22 25  2  0  0  0
 23 25  1  0  0  0
 24 27  1  0  0  0
 24 21  1  0  0  0
 25 26  1  0  0  0
 26 31  1  0  0  0
 26 32  1  0  0  0
 26 33  1  0  0  0
 27 28  1  0  0  0
 27 29  1  0  0  0
 27 30  1  0  0  0
M  CHG  1   7  -1
M  CHG  1   8  -1
M  CHG  1  11  -1
M  CHG  1  19  -1
M  CHG  1  21  -1
M  CHG  1  23  -1
M  END
$$$$
