A1MES
  CCTOOLS-0619261020

 52 52  0  0  0  0  0  0  0  0999 V2000
    4.4540    1.9930   -0.0660 C   0  0  0  0  0
    4.5560    0.6050   -0.0220 C   0  0  0  0  0
    5.8260    0.0040    0.0670 C   0  0  0  0  0
    6.9640    0.8050    0.1090 C   0  0  0  0  0
    6.8430    2.1810    0.0650 C   0  0  0  0  0
    5.5950    2.7720   -0.0220 C   0  0  0  0  0
    3.3380   -0.2320   -0.0680 C   0  0  0  0  0
    5.9500   -1.4680    0.1140 C   0  0  0  0  0
    6.7260   -2.1080   -0.7820 O   0  0  0  0  0
    5.3520   -2.1010    0.9610 O   0  0  0  0  0
    2.1210    0.3450   -0.0260 N   0  0  0  0  0
    3.4340   -1.4420   -0.1430 O   0  0  0  0  0
    0.9140   -0.4840   -0.0720 C   0  0  0  0  0
   -0.3240    0.4120   -0.0100 C   0  0  0  0  0
   -1.5840   -0.4540   -0.0570 C   0  0  0  0  0
   -2.8220    0.4430    0.0040 C   0  0  0  0  0
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  -11.5770   -0.3330   -0.0000 C   0  0  0  0  0
    3.4830    2.4610   -0.1380 H   0  0  0  0  0
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    5.5120    3.8480   -0.0560 H   0  0  0  0  0
    6.7750   -3.0710   -0.7110 H   0  0  0  0  0
    2.0440    1.3100    0.0340 H   0  0  0  0  0
    0.9020   -1.0570   -0.9990 H   0  0  0  0  0
    0.9100   -1.1680    0.7780 H   0  0  0  0  0
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   -9.0910   -0.9360   -0.9420 H   0  0  0  0  0
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  1  2  2  0  0  0
  1  6  1  0  0  0
  1 24  1  0  0  0
  2  3  1  0  0  0
  3  8  1  0  0  0
  3  4  2  0  0  0
  4 25  1  0  0  0
  5  4  1  0  0  0
  5 26  1  0  0  0
  6  5  2  0  0  0
  6 27  1  0  0  0
  7  2  1  0  0  0
  7 12  2  0  0  0
  8  9  1  0  0  0
  9 28  1  0  0  0
 10  8  2  0  0  0
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 11 29  1  0  0  0
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 23 52  1  0  0  0
M  END
$$$$
