A1ELY
  CCTOOLS-0206261215

 38 41  0  0  0  0  0  0  0  0999 V2000
    4.4390    2.6020   -0.7200 C   0  0  0  0  0
    6.1160    1.5570    0.6380 C   0  0  0  0  0
   -4.7240    1.0920   -1.1250 C   0  0  0  0  0
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    2.0010   -0.7660    0.0310 C   0  0  0  0  0
    1.2300   -1.9360   -0.0500 C   0  0  0  0  0
   -0.1700   -1.8130   -0.0580 C   0  0  0  0  0
   -0.7050   -0.5240    0.0150 C   0  0  0  0  0
    1.4990   -3.3700   -0.1350 C   0  0  0  0  0
    0.3000   -3.9720   -0.1860 C   0  0  0  0  0
    4.1490    0.3360    0.0130 C   0  0  0  0  0
    3.6870    1.4440   -0.6870 C   0  0  0  0  0
    5.6530    2.6580   -0.0590 C   0  0  0  0  0
    5.3690    0.3970    0.6750 C   0  0  0  0  0
   -2.5210    1.0080    0.0890 C   0  0  0  0  0
   -4.0280    1.0150    0.0710 C   0  0  0  0  0
   -6.1330    0.9540    1.1970 C   0  0  0  0  0
    0.1090    0.5130    0.0890 N   0  0  0  0  0
    1.3860    0.4030    0.0960 N   0  0  0  0  0
    3.3910   -0.8360    0.0480 N   0  0  0  0  0
   -6.7610    1.0230    0.0400 N   0  0  0  0  0
   -0.6800   -3.0530   -0.1400 O   0  0  0  0  0
   -2.0510   -0.3390    0.0110 O   0  0  0  0  0
    4.0820    3.4620   -1.2670 H   0  0  0  0  0
    7.0650    1.6050    1.1530 H   0  0  0  0  0
   -4.1920    1.1480   -2.0640 H   0  0  0  0  0
   -6.6550    1.1460   -2.0310 H   0  0  0  0  0
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    2.4670   -3.8490   -0.1540 H   0  0  0  0  0
    0.1460   -5.0390   -0.2530 H   0  0  0  0  0
    2.7390    1.4010   -1.2030 H   0  0  0  0  0
    6.2390    3.5650   -0.0860 H   0  0  0  0  0
    5.7320   -0.4630    1.2190 H   0  0  0  0  0
   -2.1450    1.5740   -0.7630 H   0  0  0  0  0
   -2.1660    1.4640    1.0130 H   0  0  0  0  0
   -6.7040    0.9000    2.1120 H   0  0  0  0  0
    3.8320   -1.6990    0.0850 H   0  0  0  0  0
  1 13  2  0  0  0
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  1 25  1  0  0  0
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  2 26  1  0  0  0
  3 27  1  0  0  0
  4  3  1  0  0  0
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  9 19  2  0  0  0
 10  7  1  0  0  0
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 22  4  2  0  0  0
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 24  9  1  0  0  0
 24 16  1  0  0  0
M  END
$$$$
