A1B60
  CCTOOLS-0410261002

 31 32  0  0  0  0  0  0  0  0999 V2000
    3.8480    1.1820   -0.0470 C   0  0  0  0  0
    2.4830    1.1960    0.1340 C   0  0  0  0  0
    3.8270   -1.2380    0.0000 C   0  0  0  0  0
    2.4640   -1.2220    0.1920 C   0  0  0  0  0
    1.7830   -0.0050    0.2550 C   0  0  0  0  0
    0.3140    0.0110    0.4510 C   0  0  0  0  0
   -1.7360    1.2370    0.6960 C   0  0  0  0  0
   -2.4320    0.0410    0.8160 C   0  0  0  0  0
   -1.7550   -1.1700    0.7480 C   0  0  0  0  0
    5.9920   -0.0520   -0.3210 C   0  0  0  0  0
    6.5840   -1.1110   -0.3900 O   0  0  0  0  0
    4.5310   -0.0360   -0.1150 C   0  0  0  0  0
   -0.3690    1.2250    0.5130 C   0  0  0  0  0
   -0.3890   -1.1880    0.5660 C   0  0  0  0  0
   -3.7780    0.0560    0.9960 O   0  0  0  0  0
   -4.3680   -1.3670   -1.1340 O   0  0  0  0  0
   -6.1900    0.1820   -0.0420 O   0  0  0  0  0
   -4.1910    1.1480   -1.2420 O   0  0  0  0  0
   -4.6220    0.0290   -0.3750 P   0  0  0  0  0
    4.3890    2.1110   -0.1400 H   0  0  0  0  0
    1.9550    2.1360    0.1830 H   0  0  0  0  0
    4.3540   -2.1790   -0.0480 H   0  0  0  0  0
    1.9210   -2.1500    0.2810 H   0  0  0  0  0
   -2.2660    2.1770    0.7440 H   0  0  0  0  0
   -2.3000   -2.0980    0.8380 H   0  0  0  0  0
    0.1710    2.1550    0.4200 H   0  0  0  0  0
    0.1370   -2.1300    0.5130 H   0  0  0  0  0
   -4.6290   -2.1460   -0.6240 H   0  0  0  0  0
   -6.7600    0.1740   -0.8230 H   0  0  0  0  0
    6.6690    1.1070   -0.4320 O   0  0  0  0  0
    7.6250    1.0460   -0.5660 H   0  0  0  0  0
  1  2  1  0  0  0
  1 20  1  0  0  0
  2 21  1  0  0  0
  3  4  2  0  0  0
  3 12  1  0  0  0
  3 22  1  0  0  0
  4  5  1  0  0  0
  4 23  1  0  0  0
  5  6  1  0  0  0
  5  2  2  0  0  0
  6 13  2  0  0  0
  7 24  1  0  0  0
  8 15  1  0  0  0
  8  7  2  0  0  0
  9  8  1  0  0  0
  9 25  1  0  0  0
 10 12  1  0  0  0
 10 30  1  0  0  0
 11 10  2  0  0  0
 12  1  2  0  0  0
 13  7  1  0  0  0
 13 26  1  0  0  0
 14  9  2  0  0  0
 14  6  1  0  0  0
 14 27  1  0  0  0
 16 19  1  0  0  0
 16 28  1  0  0  0
 17 29  1  0  0  0
 18 19  2  0  0  0
 19 15  1  0  0  0
 19 17  1  0  0  0
 30 31  1  0  0  0
M  END
$$$$
