File: H3BNH3.mol

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file content (12 lines) | stat: -rw-r--r-- 332 bytes parent folder | download | duplicates (9)
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  Mrv0541 12071315482D          

  2  1  0  0  0  0            999 V2000
   -1.0902    0.8545    0.0000 B   0  5  0  0  0  0  0  0  0  0  0  0
   -0.2652    0.8545    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
M  CHG  2   1  -1   2   1
M  ZCH  2   1   0   2   0
M  HYD  1   1   3
M  ZBO  1   1   0
M  END