Ketcher 11212314022D 1   1.00000     0.00000     0

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    4.2758   -0.8637    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0908    0.9439    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4083    0.6387    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0908   -0.6681    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1432    0.6387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2758    1.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4083   -0.3629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6754    0.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2758   -1.8652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4020    1.8961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5409    1.1395    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  2  0     0  0
  2 10  2  0     0  0
  3  8  1  0     0  0
  3 10  1  0     0  0
  3 12  1  0     0  0
  4  7  1  0     0  0
  4 11  1  0     0  0
  4 13  1  0     0  0
  5  9  1  0     0  0
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  5 14  1  0     0  0
  6  8  1  0     0  0
  6 11  2  0     0  0
  7  8  2  0     0  0
  7  9  1  0     0  0
M  ISO  3  12  13  13  13  14  13
M  END