4AC
  CCTOOLS-1219251125

 40 41  0  0  1  0  0  0  0  0999 V2000
    1.1980    0.5880   -4.5480 O   0  0  0  0  0
    2.7870    0.3240   -4.4070 P   0  0  0  0  0
    3.6590    1.1720   -5.2860 O   0  0  0  0  0
    2.9210   -1.2700   -4.6470 O   0  0  0  0  0
    3.0630    0.4760   -2.8190 O   0  0  0  0  0
    2.2820   -0.2920   -1.9210 C   0  0  0  0  0
    2.7250    0.0230   -0.4980 C   0  0  0  0  0
    2.4700    1.4220   -0.2460 O   0  0  0  0  0
    1.9400   -0.7420    0.5600 C   0  0  0  0  0
    2.7420   -0.8090    1.7390 O   0  0  0  0  0
    0.7480    0.1630    0.7860 C   0  0  0  0  0
    0.1370   -0.0580    2.0410 O   0  0  0  0  0
    1.3730    1.5430    0.6750 C   0  0  0  0  0
    0.4520    2.5240    0.1770 N   0  0  0  0  0
   -0.3100    3.3480    1.0430 C   0  0  0  0  0
   -0.2050    3.2480    2.2670 O   0  0  0  0  0
   -1.1800    4.2740    0.4920 N   0  0  0  0  0
   -1.3040    4.3940   -0.8040 C   0  0  0  0  0
   -2.1520    5.2970   -1.3740 N   0  0  0  0  0
   -0.5240    3.5490   -1.7440 C   0  0  0  0  0
    0.3070    2.6650   -1.1950 C   0  0  0  0  0
   -2.9550    6.1630   -0.6480 C   0  0  0  0  0
   -3.0140    6.2390    0.5780 O   0  0  0  0  0
   -3.8160    7.0250   -1.5320 C   0  0  0  0  0
    0.7990    0.6160   -5.4430 H   0  0  0  0  0
    2.8860   -1.6170   -5.5630 H   0  0  0  0  0
    1.2290   -0.0350   -2.0510 H   0  0  0  0  0
    2.4280   -1.3520   -2.1330 H   0  0  0  0  0
    3.8040   -0.1390   -0.4100 H   0  0  0  0  0
    1.6750   -1.7640    0.2770 H   0  0  0  0  0
    3.4470   -0.1530    1.6280 H   0  0  0  0  0
   -0.0000    0.0040   -0.0000 H   0  0  0  0  0
   -0.4940    0.6690    2.1850 H   0  0  0  0  0
    1.7540    1.9100    1.6330 H   0  0  0  0  0
   -2.1990    5.3370   -2.3890 H   0  0  0  0  0
   -0.6390    3.6620   -2.8140 H   0  0  0  0  0
    0.9140    2.0090   -1.8080 H   0  0  0  0  0
   -4.0760    7.9460   -1.0030 H   0  0  0  0  0
   -4.7310    6.4810   -1.7840 H   0  0  0  0  0
   -3.2900    7.2940   -2.4530 H   0  0  0  0  0
  1  2  1  0  0  0
  1 25  1  0  0  0
  2  3  2  0  0  0
  2  4  1  0  0  0
  2  5  1  0  0  0
  4 26  1  0  0  0
  5  6  1  0  0  0
  6  7  1  0  0  0
  6 27  1  0  0  0
  6 28  1  0  0  0
  7  8  1  0  0  0
  7  9  1  0  0  0
  7 29  1  0  0  0
  8 13  1  0  0  0
  9 10  1  0  0  0
  9 11  1  0  0  0
  9 30  1  0  0  0
 10 31  1  0  0  0
 11 12  1  0  0  0
 11 13  1  0  0  0
 11 32  1  0  0  0
 12 33  1  0  0  0
 13 14  1  0  0  0
 13 34  1  0  0  0
 14 15  1  0  0  0
 14 21  1  0  0  0
 15 16  2  0  0  0
 15 17  1  0  0  0
 17 18  2  0  0  0
 18 19  1  0  0  0
 18 20  1  0  0  0
 19 22  1  0  0  0
 19 35  1  0  0  0
 20 21  2  0  0  0
 20 36  1  0  0  0
 21 37  1  0  0  0
 22 23  2  0  0  0
 22 24  1  0  0  0
 24 38  1  0  0  0
 24 39  1  0  0  0
 24 40  1  0  0  0
M  END
$$$$
