Calcium_Pantothenate.mol
  ChemDraw02200317502D

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    0.2749    0.1489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9877   -0.2612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.4530   -0.9740    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1634    0.8640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.7004    0.9740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4149   -0.2635    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.0012    0.1031    0.0000 Ca  0  2  0  0  0  0  0  0  0  0  0  0
  1  2  1  0      
  2  3  1  0      
  3  4  1  0      
  4  5  1  0      
  5  6  1  0      
  6  7  1  0      
  7  8  1  0      
  5  9  2  0      
  4 10  1  6      
  4 11  1  1      
  3 12  1  0      
  3 13  1  0      
  8 14  1  0      
 14 15  2  0      
 14 16  1  0      
M  CHG  2  16  -1  17   2
M  STY  1   1 SUP
M  SLB  1   1   1
M  SAL   1  3  14  15  16
M  SBL   1  1  13
M  SMT   1 CO2
M  SBV   1 13   -4.6452    2.1771
M  END