A1J52
  CCTOOLS-0501261012

 57 61  0  0  1  0  0  0  0  0999 V2000
   -0.1120    3.1860    0.1660 C   0  0  0  0  0
    1.2570    2.9640    0.4120 C   0  0  0  0  0
   -0.2890    4.5810    0.0430 C   0  0  0  0  0
    0.8470    0.6970    0.5020 C   0  0  0  0  0
    2.7640   -0.7970    0.9300 C   0  0  0  0  0
    4.3380   -2.6130    1.0260 C   0  0  0  0  0
   -6.3000   -0.6240   -0.6260 C   0  0  0  0  0
   -3.8620   -1.0030   -0.1720 C   0  0  0  0  0
   -3.9030   -2.5070   -0.0720 C   0  0  0  0  0
   -5.0000   -2.9240    0.9090 C   0  0  0  0  0
   -4.1990   -3.1010   -1.4510 C   0  0  0  0  0
   -2.5510   -3.0220    0.4250 C   0  0  0  0  0
   -2.7630   -0.2260   -0.0410 C   0  0  0  0  0
   -3.1600    1.1110   -0.2020 C   0  0  0  0  0
   -0.9700    2.0700    0.1000 C   0  0  0  0  0
    2.9890   -2.1590    1.6210 C   0  0  0  0  0
    4.4280   -1.9290   -0.3210 C   0  0  0  0  0
    3.5230   -0.8850   -0.3760 C   0  0  0  0  0
    3.4300   -0.1130   -1.5220 C   0  0  0  0  0
    4.2370   -0.3840   -2.6100 C   0  0  0  0  0
    5.1420   -1.4270   -2.5550 C   0  0  0  0  0
    5.2370   -2.1980   -1.4130 C   0  0  0  0  0
   -4.9150   -0.1940   -0.4130 N   0  0  0  0  0
   -2.3210    2.2310   -0.1400 N   0  0  0  0  0
    1.8530    4.1900    0.4260 N   0  0  0  0  0
    0.8680    5.1590    0.1950 N   0  0  0  0  0
    1.6890    1.7140    0.5730 N   0  0  0  0  0
    1.3370   -0.5860    0.6760 N   0  0  0  0  0
   -0.4510    0.8610    0.2730 N   0  0  0  0  0
   -4.4530    1.1280   -0.4220 N   0  0  0  0  0
    3.0860   -2.0000    3.0380 O   0  0  0  0  0
   -1.2260    5.0840   -0.1440 H   0  0  0  0  0
    3.1620    0.0090    1.5460 H   0  0  0  0  0
    5.1600   -2.2950    1.6670 H   0  0  0  0  0
    4.3520   -3.6960    0.9030 H   0  0  0  0  0
   -6.7940   -0.7470    0.3380 H   0  0  0  0  0
   -6.8280    0.1280   -1.2110 H   0  0  0  0  0
   -6.3070   -1.5730   -1.1610 H   0  0  0  0  0
   -5.9630   -2.5570    0.5540 H   0  0  0  0  0
   -5.0300   -4.0110    0.9810 H   0  0  0  0  0
   -4.7890   -2.5000    1.8910 H   0  0  0  0  0
   -3.3730   -2.8790   -2.1270 H   0  0  0  0  0
   -4.3160   -4.1810   -1.3630 H   0  0  0  0  0
   -5.1180   -2.6670   -1.8440 H   0  0  0  0  0
   -2.3400   -2.5980    1.4070 H   0  0  0  0  0
   -2.5800   -4.1090    0.4970 H   0  0  0  0  0
   -1.7690   -2.7250   -0.2740 H   0  0  0  0  0
   -1.7590   -0.5730    0.1540 H   0  0  0  0  0
    2.1930   -2.8590    1.3650 H   0  0  0  0  0
    2.7230    0.7020   -1.5660 H   0  0  0  0  0
    4.1610    0.2200   -3.5020 H   0  0  0  0  0
    5.7730   -1.6400   -3.4040 H   0  0  0  0  0
    5.9440   -3.0130   -1.3700 H   0  0  0  0  0
   -2.6890    3.1200   -0.2650 H   0  0  0  0  0
    2.7960    4.3620    0.5730 H   0  0  0  0  0
    0.7350   -1.3450    0.6290 H   0  0  0  0  0
    3.2270   -2.8280    3.5180 H   0  0  0  0  0
  1 15  1  0  0  0
  2  1  2  0  0  0
  2 27  1  0  0  0
  3  1  1  0  0  0
  3 32  1  0  0  0
  4 29  1  0  0  0
  4 28  1  0  0  0
  5 18  1  0  0  0
  5 16  1  0  0  0
  5 33  1  0  0  0
  6 34  1  0  0  0
  6 35  1  0  0  0
  7 36  1  0  0  0
  7 37  1  0  0  0
  7 38  1  0  0  0
  8  9  1  0  0  0
  9 12  1  0  0  0
  9 11  1  0  0  0
 10  9  1  0  0  0
 10 39  1  0  0  0
 10 40  1  0  0  0
 10 41  1  0  0  0
 11 42  1  0  0  0
 11 43  1  0  0  0
 11 44  1  0  0  0
 12 45  1  0  0  0
 12 46  1  0  0  0
 12 47  1  0  0  0
 13  8  2  0  0  0
 13 48  1  0  0  0
 14 13  1  0  0  0
 15 29  2  0  0  0
 16 31  1  0  0  0
 16  6  1  0  0  0
 16 49  1  0  0  0
 17 22  1  0  0  0
 17  6  1  0  0  0
 18 17  2  0  0  0
 19 20  2  0  0  0
 19 18  1  0  0  0
 19 50  1  0  0  0
 20 21  1  0  0  0
 20 51  1  0  0  0
 21 22  2  0  0  0
 21 52  1  0  0  0
 22 53  1  0  0  0
 23  7  1  0  0  0
 23  8  1  0  0  0
 24 15  1  0  0  0
 24 14  1  0  0  0
 24 54  1  0  0  0
 25  2  1  0  0  0
 25 55  1  0  0  0
 26 25  1  0  0  0
 26  3  2  0  0  0
 27  4  2  0  0  0
 28  5  1  0  0  0
 28 56  1  0  0  0
 30 14  2  0  0  0
 30 23  1  0  0  0
 31 57  1  0  0  0
M  END
$$$$
