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Text File  |  1991-05-20  |  692b  |  22 lines
  1. * Data SCSI::Winchester.$.!Molecule.EthAcetate
  2. DATA
  3. 16
  4. -1.78947, 0.50040,-0.30216,  1,  2,  3,  4,  5
  5. -2.17464, 1.54357,-0.34897,  5,  1
  6. -0.30111, 0.52136,-0.02701,  3,  1,  6,  7
  7. -1.97634,-0.00804,-1.27444,  5,  1
  8. -2.31115,-0.05155, 0.51145,  5,  1
  9.  0.33814, 1.53670, 0.12024,  7,  3
  10.  0.36168,-0.78024, 0.07154,  6,  3,  8,  9, 10
  11.  1.75027,-0.74274, 0.35199,  1,  7, 11, 12, 13
  12.  0.13011,-1.00912, 0.57551, 20,  7
  13.  0.34730,-0.97953,-0.49420, 20,  7
  14.  2.26102,-2.18530, 0.41434,  1,  8, 14, 15, 16
  15.  2.29217,-0.20395,-0.45837,  5,  8
  16.  1.93113,-0.25431, 1.33655,  5,  8
  17.  3.35342,-2.21299, 0.63453,  5, 11
  18.  1.73595,-2.76072, 1.21170,  5, 11
  19.  2.09318,-2.71058,-0.55441,  5, 11
  20. LEGEND
  21. Ethyl Acetate
  22.