File: tbp.mol

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file content (16 lines) | stat: -rw-r--r-- 736 bytes parent folder | download | duplicates (15)
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15602                                                                           
           8 49915 33D                        15602       
                                                                        
  6  5        0                 1 V2000
    0.0021   -0.0041    0.0020 Sb  0  0  0  0  0  0  0  0  0
   -0.0256    2.0357    0.0132 O   0  0  0  0  0  0  0  0  0
    0.0297   -2.0438   -0.0092 O   0  0  0  0  0  0  0  0  0
   -2.0376   -0.0318    0.0213 H   0  0  0  0  0  0  0  0  0
    1.0051    0.0193   -1.7742 H   0  0  0  0  0  0  0  0  0
    1.0388    0.0003    1.7589 H   0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
M  END