MXK
  CCTOOLS-0919241036

 48 50  0  0  1  0  0  0  0  0999 V2000
    2.4510   -0.4400    0.5320 C   0  0  0  0  0
    3.8130    1.5570    0.2270 C   0  0  0  0  0
    4.1890    2.7660   -0.5320 C   0  0  0  0  0
    3.3530   -1.5810    0.1380 C   0  0  0  0  0
    4.5380   -2.8000   -1.5470 C   0  0  0  0  0
    4.6450   -3.5050    0.7390 C   0  0  0  0  0
   -6.3760   -0.1580   -0.7120 C   0  0  0  0  0
   -7.0640    1.8010   -0.1220 C   0  0  0  0  0
   -6.2040    1.3880    0.8290 C   0  0  0  0  0
   -4.8170   -0.6980    1.1840 C   0  0  0  0  0
   -3.4300   -0.4830    0.6340 C   0  0  0  0  0
   -2.3270   -0.1290    1.3340 C   0  0  0  0  0
    0.0720    0.2980    0.7340 C   0  0  0  0  0
    3.8180   -2.4580    1.1000 C   0  0  0  0  0
   -6.1960   -1.4350   -1.4900 C   0  0  0  0  0
    0.9990   -0.8070    0.2210 C   0  0  0  0  0
    3.7110   -1.7530   -1.1860 C   0  0  0  0  0
    5.0080   -3.6740   -0.5850 C   0  0  0  0  0
   -7.1500    0.8370   -1.0500 N   0  0  0  0  0
   -5.7670    0.1460    0.4550 N   0  0  0  0  0
   -1.3180   -0.0540    0.4360 N   0  0  0  0  0
    2.8240    0.7600   -0.2220 N   0  0  0  0  0
    5.1380    3.5310   -0.1020 N   0  0  0  0  0
   -1.7910   -0.3440   -0.7260 N   0  0  0  0  0
   -3.0460   -0.6100   -0.6410 N   0  0  0  0  0
    4.3970    1.2810    1.2570 O   0  0  0  0  0
    5.4990    4.6900   -0.8300 O   0  0  0  0  0
    2.5560   -0.2450    1.5990 H   0  0  0  0  0
    3.6710    3.0110   -1.4470 H   0  0  0  0  0
    4.8180   -2.9350   -2.5820 H   0  0  0  0  0
    5.0090   -4.1900    1.4900 H   0  0  0  0  0
   -7.5930    2.7420   -0.1330 H   0  0  0  0  0
   -5.9150    1.9320    1.7150 H   0  0  0  0  0
   -5.0960   -1.7450    1.0670 H   0  0  0  0  0
   -4.8330   -0.4330    2.2410 H   0  0  0  0  0
   -2.2640    0.0560    2.3970 H   0  0  0  0  0
    0.1970    0.4050    1.8110 H   0  0  0  0  0
    0.3220    1.2390    0.2430 H   0  0  0  0  0
    3.5350   -2.3260    2.1340 H   0  0  0  0  0
   -6.9320   -2.1680   -1.1610 H   0  0  0  0  0
   -6.3330   -1.2350   -2.5530 H   0  0  0  0  0
   -5.1930   -1.8260   -1.3210 H   0  0  0  0  0
    0.8740   -0.9140   -0.8570 H   0  0  0  0  0
    0.7490   -1.7470    0.7110 H   0  0  0  0  0
    3.3440   -1.0710   -1.9380 H   0  0  0  0  0
    5.6540   -4.4920   -0.8670 H   0  0  0  0  0
    2.3590    0.9810   -1.0440 H   0  0  0  0  0
    6.2180    5.1980   -0.4310 H   0  0  0  0  0
  1 16  1  0  0  0
  1 28  1  0  0  0
  2  3  1  0  0  0
  3 23  2  0  0  0
  3 29  1  0  0  0
  4  1  1  0  0  0
  5 17  2  0  0  0
  5 30  1  0  0  0
  6 14  1  0  0  0
  6 31  1  0  0  0
  7 20  1  0  0  0
  7 19  2  0  0  0
  8 32  1  0  0  0
  9  8  2  0  0  0
  9 33  1  0  0  0
 10 20  1  0  0  0
 10 11  1  0  0  0
 10 34  1  0  0  0
 10 35  1  0  0  0
 11 25  1  0  0  0
 12 11  2  0  0  0
 12 21  1  0  0  0
 12 36  1  0  0  0
 13 37  1  0  0  0
 13 38  1  0  0  0
 14  4  2  0  0  0
 14 39  1  0  0  0
 15  7  1  0  0  0
 15 40  1  0  0  0
 15 41  1  0  0  0
 15 42  1  0  0  0
 16 13  1  0  0  0
 16 43  1  0  0  0
 16 44  1  0  0  0
 17  4  1  0  0  0
 17 45  1  0  0  0
 18  6  2  0  0  0
 18  5  1  0  0  0
 18 46  1  0  0  0
 19  8  1  0  0  0
 20  9  1  0  0  0
 21 13  1  0  0  0
 21 24  1  0  0  0
 22  2  1  0  0  0
 22  1  1  0  0  0
 22 47  1  0  0  0
 23 27  1  0  0  0
 25 24  2  0  0  0
 26  2  2  0  0  0
 27 48  1  0  0  0
M  END
$$$$
