A1JKA
  CCTOOLS-0731261038

 46 48  0  0  0  0  0  0  0  0999 V2000
    1.3510   -1.8210    1.1940 C   0  0  0  0  0
    0.3750   -0.7000   -0.7180 C   0  0  0  0  0
   -1.0350   -0.7250   -0.1250 C   0  0  0  0  0
   -2.0610   -0.8220   -1.2550 C   0  0  0  0  0
   -3.4510   -0.8480   -0.6720 C   0  0  0  0  0
   -4.1790   -1.9400   -0.3900 C   0  0  0  0  0
   -4.2600    0.3150   -0.2990 C   0  0  0  0  0
   -4.0560    1.6950   -0.3460 C   0  0  0  0  0
   -5.0360    2.5410    0.0900 C   0  0  0  0  0
   -6.2340    2.0390    0.5800 C   0  0  0  0  0
   -6.4570    0.6810    0.6360 C   0  0  0  0  0
    2.7050   -0.3420   -0.1630 C   0  0  0  0  0
    3.6520   -0.0050    0.9900 C   0  0  0  0  0
    5.0300    0.2660    0.4460 C   0  0  0  0  0
    5.9340   -0.7700    0.3050 C   0  0  0  0  0
    7.5600    0.7650   -0.5520 C   0  0  0  0  0
    6.6540    1.8000   -0.4170 C   0  0  0  0  0
    5.3890    1.5510    0.0820 C   0  0  0  0  0
   -5.4720   -0.1990    0.1970 C   0  0  0  0  0
    7.1990   -0.5210   -0.1940 C   0  0  0  0  0
    1.3610   -0.6070    0.3670 N   0  0  0  0  0
   -5.3900   -1.5710    0.1280 N   0  0  0  0  0
    1.5940   -2.6840    0.5740 H   0  0  0  0  0
    2.0900   -1.7260    1.9890 H   0  0  0  0  0
    0.3620   -1.9550    1.6310 H   0  0  0  0  0
    0.5470   -1.6130   -1.2870 H   0  0  0  0  0
    0.4770    0.1630   -1.3760 H   0  0  0  0  0
   -1.1370   -1.5880    0.5330 H   0  0  0  0  0
   -1.2060    0.1880    0.4440 H   0  0  0  0  0
   -1.9600    0.0400   -1.9140 H   0  0  0  0  0
   -1.8900   -1.7360   -1.8250 H   0  0  0  0  0
   -3.8560   -2.9580   -0.5480 H   0  0  0  0  0
   -3.1260    2.0930   -0.7260 H   0  0  0  0  0
   -4.8770    3.6090    0.0540 H   0  0  0  0  0
   -6.9990    2.7210    0.9220 H   0  0  0  0  0
   -7.3920    0.3010    1.0190 H   0  0  0  0  0
    2.6630    0.4990   -0.8560 H   0  0  0  0  0
    3.0700   -1.2260   -0.6860 H   0  0  0  0  0
    3.2870    0.8790    1.5140 H   0  0  0  0  0
    3.6940   -0.8460    1.6830 H   0  0  0  0  0
    5.6530   -1.7740    0.5850 H   0  0  0  0  0
    8.5480    0.9590   -0.9420 H   0  0  0  0  0
    6.9360    2.8040   -0.6970 H   0  0  0  0  0
    4.6810    2.3600    0.1880 H   0  0  0  0  0
    7.9070   -1.3300   -0.3000 H   0  0  0  0  0
   -6.0880   -2.1860    0.4050 H   0  0  0  0  0
  1 23  1  0  0  0
  1 24  1  0  0  0
  1 25  1  0  0  0
  2 21  1  0  0  0
  2 26  1  0  0  0
  2 27  1  0  0  0
  3  2  1  0  0  0
  3 28  1  0  0  0
  3 29  1  0  0  0
  4  3  1  0  0  0
  4 30  1  0  0  0
  4 31  1  0  0  0
  5  4  1  0  0  0
  5  7  1  0  0  0
  6  5  2  0  0  0
  6 32  1  0  0  0
  7 19  2  0  0  0
  8  7  1  0  0  0
  8 33  1  0  0  0
  9  8  2  0  0  0
  9 34  1  0  0  0
 10  9  1  0  0  0
 10 35  1  0  0  0
 11 10  2  0  0  0
 11 36  1  0  0  0
 12 21  1  0  0  0
 12 37  1  0  0  0
 12 38  1  0  0  0
 13 12  1  0  0  0
 13 39  1  0  0  0
 13 40  1  0  0  0
 14 13  1  0  0  0
 14 18  1  0  0  0
 15 14  2  0  0  0
 15 41  1  0  0  0
 16 20  2  0  0  0
 16 42  1  0  0  0
 17 16  1  0  0  0
 17 43  1  0  0  0
 18 17  2  0  0  0
 18 44  1  0  0  0
 19 22  1  0  0  0
 19 11  1  0  0  0
 20 15  1  0  0  0
 20 45  1  0  0  0
 21  1  1  0  0  0
 22  6  1  0  0  0
 22 46  1  0  0  0
M  END
$$$$
