A1ETJ
  CCTOOLS-0619261019

 51 55  0  0  0  0  0  0  0  0999 V2000
    0.4900    2.3720    0.0580 C   0  0  0  0  0
   -2.9110    1.5730   -1.3730 C   0  0  0  0  0
   -5.1010    0.9640   -0.3260 C   0  0  0  0  0
   -6.6190   -0.8770   -0.7650 C   0  0  0  0  0
   -4.8630   -1.1520    0.8430 C   0  0  0  0  0
   -3.0360    1.4180    1.0130 C   0  0  0  0  0
   -1.6970    1.7520    1.1040 C   0  0  0  0  0
    4.5550    2.7570    0.2850 C   0  0  0  0  0
    4.8570    0.3800    0.1200 C   0  0  0  0  0
    4.4770   -1.8510   -0.0630 C   0  0  0  0  0
    4.5530   -3.2360   -0.1630 C   0  0  0  0  0
    3.4010   -3.9850   -0.2690 C   0  0  0  0  0
    2.1590   -3.3700   -0.2790 C   0  0  0  0  0
    2.0630   -1.9980   -0.1810 C   0  0  0  0  0
    3.2190   -1.2300   -0.0730 C   0  0  0  0  0
    3.4670    0.2180    0.0460 C   0  0  0  0  0
    2.6300    1.3370    0.0870 C   0  0  0  0  0
   -0.9690    2.0080   -0.0420 C   0  0  0  0  0
   -1.5740    1.9130   -1.2810 C   0  0  0  0  0
   -3.6420    1.3280   -0.2260 C   0  0  0  0  0
   -7.1120   -1.8330    0.3410 C   0  0  0  0  0
   -5.7920   -2.3880    0.9370 C   0  0  0  0  0
    3.1800    2.6000    0.2060 C   0  0  0  0  0
    5.3900    1.6610    0.2390 C   0  0  0  0  0
   -5.2350   -0.4950   -0.4280 N   0  0  0  0  0
    5.4460   -0.8700    0.0520 N   0  0  0  0  0
    1.2820    1.1830    0.0090 O   0  0  0  0  0
    0.7600    3.0230   -0.7740 H   0  0  0  0  0
    0.6720    2.8910    0.9990 H   0  0  0  0  0
   -3.3850    1.5030   -2.3410 H   0  0  0  0  0
   -5.6250    1.3160    0.5620 H   0  0  0  0  0
   -5.5320    1.4310   -1.2110 H   0  0  0  0  0
   -6.6400   -1.3830   -1.7300 H   0  0  0  0  0
   -7.2500    0.0120   -0.7990 H   0  0  0  0  0
   -5.0380   -0.4800    1.6830 H   0  0  0  0  0
   -3.8180   -1.4640    0.8190 H   0  0  0  0  0
   -3.6070    1.2280    1.9090 H   0  0  0  0  0
   -1.2230    1.8230    2.0720 H   0  0  0  0  0
    4.9760    3.7470    0.3770 H   0  0  0  0  0
    5.5160   -3.7260   -0.1570 H   0  0  0  0  0
    3.4660   -5.0600   -0.3470 H   0  0  0  0  0
    1.2630   -3.9670   -0.3630 H   0  0  0  0  0
    1.0940   -1.5210   -0.1890 H   0  0  0  0  0
   -1.0020    2.1040   -2.1780 H   0  0  0  0  0
   -7.6780   -1.2890    1.0970 H   0  0  0  0  0
   -7.7110   -2.6380   -0.0850 H   0  0  0  0  0
   -5.4080   -3.2120    0.3360 H   0  0  0  0  0
   -5.9300   -2.6940    1.9740 H   0  0  0  0  0
    2.5370    3.4670    0.2390 H   0  0  0  0  0
    6.4600    1.7970    0.2960 H   0  0  0  0  0
    6.4020   -1.0350    0.0820 H   0  0  0  0  0
  1 28  1  0  0  0
  1 29  1  0  0  0
  2 20  1  0  0  0
  2 30  1  0  0  0
  3 25  1  0  0  0
  3 31  1  0  0  0
  3 32  1  0  0  0
  4 25  1  0  0  0
  4 33  1  0  0  0
  4 34  1  0  0  0
  5 35  1  0  0  0
  5 36  1  0  0  0
  6 37  1  0  0  0
  7  6  1  0  0  0
  7 38  1  0  0  0
  8 39  1  0  0  0
  9 24  1  0  0  0
 10 15  1  0  0  0
 10 26  1  0  0  0
 11 10  2  0  0  0
 11 40  1  0  0  0
 12 13  2  0  0  0
 12 11  1  0  0  0
 12 41  1  0  0  0
 13 14  1  0  0  0
 13 42  1  0  0  0
 14 15  2  0  0  0
 14 43  1  0  0  0
 15 16  1  0  0  0
 16  9  2  0  0  0
 16 17  1  0  0  0
 17 23  2  0  0  0
 18  1  1  0  0  0
 18  7  2  0  0  0
 19  2  2  0  0  0
 19 18  1  0  0  0
 19 44  1  0  0  0
 20  3  1  0  0  0
 20  6  2  0  0  0
 21  4  1  0  0  0
 21 22  1  0  0  0
 21 45  1  0  0  0
 21 46  1  0  0  0
 22  5  1  0  0  0
 22 47  1  0  0  0
 22 48  1  0  0  0
 23  8  1  0  0  0
 23 49  1  0  0  0
 24  8  2  0  0  0
 24 50  1  0  0  0
 25  5  1  0  0  0
 26  9  1  0  0  0
 26 51  1  0  0  0
 27 17  1  0  0  0
 27  1  1  0  0  0
M  END
$$$$
