A1BLW
  CCTOOLS-0731261037

 44 46  0  0  0  0  0  0  0  0999 V2000
    8.5650    2.0430   -0.1670 C   0  0  0  0  0
   -1.2360   -0.1230    0.1270 C   0  0  0  0  0
   -3.5660   -0.5170   -0.6120 C   0  0  0  0  0
   -4.9160    0.1420   -0.4970 C   0  0  0  0  0
   -5.3200    1.0590   -1.4500 C   0  0  0  0  0
   -6.5580    1.6650   -1.3440 C   0  0  0  0  0
   -7.3920    1.3530   -0.2860 C   0  0  0  0  0
    7.1270    1.7200   -0.5790 C   0  0  0  0  0
   -6.9880    0.4360    0.6660 C   0  0  0  0  0
   -7.8970    0.0970    1.8190 C   0  0  0  0  0
   -5.7520   -0.1730    0.5570 C   0  0  0  0  0
    0.8860   -0.1390    0.5810 C   0  0  0  0  0
    5.2650    0.4410    0.1820 C   0  0  0  0  0
    4.5830   -0.4880    1.1530 C   0  0  0  0  0
    3.1770   -0.7600    0.6840 C   0  0  0  0  0
    2.9110   -1.8600   -0.0560 C   0  0  0  0  0
    1.5920   -2.1060   -0.4900 C   0  0  0  0  0
    0.6120   -1.2440   -0.1640 N   0  0  0  0  0
   -0.7620   -1.2110   -0.4360 N   0  0  0  0  0
   -2.5670    0.2890    0.0940 N   0  0  0  0  0
   -0.2410    0.5240    0.7410 N   0  0  0  0  0
    2.1720    0.1040    1.0070 N   0  0  0  0  0
    1.3400   -3.0940   -1.1570 O   0  0  0  0  0
    6.5330    0.8240    0.3980 O   0  0  0  0  0
    4.6700    0.8410   -0.7910 O   0  0  0  0  0
    9.1450    1.1210   -0.1200 H   0  0  0  0  0
    9.0100    2.7150   -0.9000 H   0  0  0  0  0
    8.5630    2.5220    0.8120 H   0  0  0  0  0
   -3.6090   -1.5120   -0.1690 H   0  0  0  0  0
   -3.2890   -0.5990   -1.6630 H   0  0  0  0  0
   -4.6690    1.3030   -2.2760 H   0  0  0  0  0
   -6.8740    2.3810   -2.0880 H   0  0  0  0  0
   -8.3580    1.8300   -0.2010 H   0  0  0  0  0
    6.5470    2.6410   -0.6260 H   0  0  0  0  0
    7.1280    1.2400   -1.5580 H   0  0  0  0  0
   -8.5340   -0.7430    1.5440 H   0  0  0  0  0
   -7.2960   -0.1710    2.6880 H   0  0  0  0  0
   -8.5170    0.9610    2.0590 H   0  0  0  0  0
   -5.4360   -0.8900    1.3010 H   0  0  0  0  0
    5.1350   -1.4260    1.2080 H   0  0  0  0  0
    4.5540   -0.0250    2.1390 H   0  0  0  0  0
    3.7050   -2.5460   -0.3130 H   0  0  0  0  0
   -2.8320    1.1090    0.5390 H   0  0  0  0  0
    2.3640    0.8930    1.5370 H   0  0  0  0  0
  1 26  1  0  0  0
  1 27  1  0  0  0
  1 28  1  0  0  0
  2 19  2  0  0  0
  3 29  1  0  0  0
  3 30  1  0  0  0
  4  3  1  0  0  0
  5  4  1  0  0  0
  5 31  1  0  0  0
  6  5  2  0  0  0
  6 32  1  0  0  0
  7  9  2  0  0  0
  7  6  1  0  0  0
  7 33  1  0  0  0
  8  1  1  0  0  0
  8 34  1  0  0  0
  8 35  1  0  0  0
  9 11  1  0  0  0
 10  9  1  0  0  0
 10 36  1  0  0  0
 10 37  1  0  0  0
 10 38  1  0  0  0
 11  4  2  0  0  0
 11 39  1  0  0  0
 12 22  1  0  0  0
 12 18  1  0  0  0
 13 25  2  0  0  0
 13 24  1  0  0  0
 14 13  1  0  0  0
 14 40  1  0  0  0
 14 41  1  0  0  0
 15 14  1  0  0  0
 15 16  2  0  0  0
 16 42  1  0  0  0
 17 16  1  0  0  0
 17 23  2  0  0  0
 18 17  1  0  0  0
 19 18  1  0  0  0
 20  3  1  0  0  0
 20  2  1  0  0  0
 20 43  1  0  0  0
 21  2  1  0  0  0
 21 12  2  0  0  0
 22 15  1  0  0  0
 22 44  1  0  0  0
 24  8  1  0  0  0
M  END
$$$$
