A1ETR
  CCTOOLS-0710261011

 52 55  0  0  1  0  0  0  0  0999 V2000
   -7.0020    0.7980   -1.3240 C   0  0  0  0  0
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   -6.8720   -0.0600    0.9050 C   0  0  0  0  0
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   -2.7000   -0.0370    0.5620 C   0  0  0  0  0
   -3.5250    0.0130   -0.6020 O   0  0  0  0  0
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    1.3030   -1.0180   -0.5660 C   0  0  0  0  0
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   -7.7510    1.2850   -2.3450 O   0  0  0  0  0
    2.5760   -1.3300   -0.9240 O   0  0  0  0  0
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    7.0010    1.5760    0.7030 O   0  0  0  0  0
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   -8.6850    0.5440   -0.0180 H   0  0  0  0  0
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    4.4850    1.1990    1.4350 H   0  0  0  0  0
    5.2980    3.4210    0.5910 H   0  0  0  0  0
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    3.4880   -0.9490    0.8910 H   0  0  0  0  0
    4.3280   -3.1990   -0.8360 H   0  0  0  0  0
    7.5000   -2.0160   -0.2300 H   0  0  0  0  0
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    3.0810    4.3050    0.4860 H   0  0  0  0  0
  1  2  2  0  0  0
  2  3  1  0  0  0
  2 31  1  0  0  0
  3 32  1  0  0  0
  4  7  1  0  0  0
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 10  9  1  0  0  0
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M  END
$$$$
