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CHEMICAL molecule Data  |  1988-06-26  |  4.1 KB  |  99 lines
  1. chemical_name("Cl2O7")
  2. chemical(a(9,"O ",o("2s",1,"σ",2)))
  3. chemical(a(2,"Cl",o("sp3~",1,"σ",9)))
  4. chemical(a(8,"O ",o("2s",1,"σ",2)))
  5. chemical(a(2,"Cl",o("sp3^",1,"σ",8)))
  6. chemical(a(7,"O ",o("2s",1,"σ",2)))
  7. chemical(a(2,"Cl",o("sp3`",1,"σ",7)))
  8. chemical(a(6,"O ",o("2s",1,"σ",1)))
  9. chemical(a(1,"Cl",o("sp3~",1,"σ",6)))
  10. chemical(a(5,"O ",o("2s",1,"σ",1)))
  11. chemical(a(1,"Cl",o("sp3^",1,"σ",5)))
  12. chemical(a(4,"O ",o("2s",1,"σ",1)))
  13. chemical(a(1,"Cl",o("sp3`",1,"σ",4)))
  14. chemical(a(2,"Cl",o("sp3'",1,"σ",3)))
  15. chemical(a(3,"O ",o("sp_5'",1,"σ",2)))
  16. chemical(a(3,"O ",o("sp_5`",1,"σ",1)))
  17. chemical(a(1,"Cl",o("sp3'",1,"σ",3)))
  18. chemical(a(1,"Cl",o("3d(a)",0,"no",0)))
  19. chemical(a(1,"Cl",o("3d(b)",0,"no",0)))
  20. chemical(a(1,"Cl",o("3d(c)",0,"no",0)))
  21. chemical(a(1,"Cl",o("3d(d)",0,"no",0)))
  22. chemical(a(1,"Cl",o("3d(e)",0,"no",0)))
  23. chemical(a(2,"Cl",o("3d(a)",0,"no",0)))
  24. chemical(a(2,"Cl",o("3d(b)",0,"no",0)))
  25. chemical(a(2,"Cl",o("3d(c)",0,"no",0)))
  26. chemical(a(2,"Cl",o("3d(d)",0,"no",0)))
  27. chemical(a(2,"Cl",o("3d(e)",0,"no",0)))
  28. chemical(a(3,"O ",o("3d(a)",0,"no",0)))
  29. chemical(a(3,"O ",o("3d(b)",0,"no",0)))
  30. chemical(a(3,"O ",o("3d(c)",0,"no",0)))
  31. chemical(a(3,"O ",o("3d(d)",0,"no",0)))
  32. chemical(a(3,"O ",o("3d(e)",0,"no",0)))
  33. chemical(a(4,"O ",o("3p(x)",2,"no",0)))
  34. chemical(a(4,"O ",o("3p(y)",1,"no",0)))
  35. chemical(a(4,"O ",o("3p(z)",1,"no",0)))
  36. chemical(a(4,"O ",o("3d(a)",0,"no",0)))
  37. chemical(a(4,"O ",o("3d(b)",0,"no",0)))
  38. chemical(a(4,"O ",o("3d(c)",0,"no",0)))
  39. chemical(a(4,"O ",o("3d(d)",0,"no",0)))
  40. chemical(a(4,"O ",o("3d(e)",0,"no",0)))
  41. chemical(a(5,"O ",o("3p(x)",2,"no",0)))
  42. chemical(a(5,"O ",o("3p(y)",1,"no",0)))
  43. chemical(a(5,"O ",o("3p(z)",1,"no",0)))
  44. chemical(a(5,"O ",o("3d(a)",0,"no",0)))
  45. chemical(a(5,"O ",o("3d(b)",0,"no",0)))
  46. chemical(a(5,"O ",o("3d(c)",0,"no",0)))
  47. chemical(a(5,"O ",o("3d(d)",0,"no",0)))
  48. chemical(a(5,"O ",o("3d(e)",0,"no",0)))
  49. chemical(a(6,"O ",o("3p(x)",2,"no",0)))
  50. chemical(a(6,"O ",o("3p(y)",1,"no",0)))
  51. chemical(a(6,"O ",o("3p(z)",1,"no",0)))
  52. chemical(a(6,"O ",o("3d(a)",0,"no",0)))
  53. chemical(a(6,"O ",o("3d(b)",0,"no",0)))
  54. chemical(a(6,"O ",o("3d(c)",0,"no",0)))
  55. chemical(a(6,"O ",o("3d(d)",0,"no",0)))
  56. chemical(a(6,"O ",o("3d(e)",0,"no",0)))
  57. chemical(a(7,"O ",o("3p(x)",2,"no",0)))
  58. chemical(a(7,"O ",o("3p(y)",1,"no",0)))
  59. chemical(a(7,"O ",o("3p(z)",1,"no",0)))
  60. chemical(a(7,"O ",o("3d(a)",0,"no",0)))
  61. chemical(a(7,"O ",o("3d(b)",0,"no",0)))
  62. chemical(a(7,"O ",o("3d(c)",0,"no",0)))
  63. chemical(a(7,"O ",o("3d(d)",0,"no",0)))
  64. chemical(a(7,"O ",o("3d(e)",0,"no",0)))
  65. chemical(a(8,"O ",o("3p(x)",2,"no",0)))
  66. chemical(a(8,"O ",o("3p(y)",1,"no",0)))
  67. chemical(a(8,"O ",o("3p(z)",1,"no",0)))
  68. chemical(a(8,"O ",o("3d(a)",0,"no",0)))
  69. chemical(a(8,"O ",o("3d(b)",0,"no",0)))
  70. chemical(a(8,"O ",o("3d(c)",0,"no",0)))
  71. chemical(a(8,"O ",o("3d(d)",0,"no",0)))
  72. chemical(a(8,"O ",o("3d(e)",0,"no",0)))
  73. chemical(a(9,"O ",o("3p(x)",2,"no",0)))
  74. chemical(a(9,"O ",o("3p(y)",1,"no",0)))
  75. chemical(a(9,"O ",o("3p(z)",1,"no",0)))
  76. chemical(a(9,"O ",o("3d(a)",0,"no",0)))
  77. chemical(a(9,"O ",o("3d(b)",0,"no",0)))
  78. chemical(a(9,"O ",o("3d(c)",0,"no",0)))
  79. chemical(a(9,"O ",o("3d(d)",0,"no",0)))
  80. chemical(a(9,"O ",o("3d(e)",0,"no",0)))
  81. chemical(a(3,"O ",o("3p(x)",2,"no",0)))
  82. chemical(a(3,"O ",o("3p(z)",2,"no",0)))
  83. atomlocation(9,l(-1686,1806,-2147,0.7,0.10664673442,-4.3871996824,6.2815439623,269),1)
  84. atomlocation(8,l(-2256,52,1085,0.7,0.95107603064,-2.4424164687,0.26692025172,269),1)
  85. atomlocation(7,l(-1109,3581,1064,0.7,5.2010044,-1.707214564,6.2018013504,269),1)
  86. atomlocation(6,l(1196,-2161,-2147,0.7,5.9431972842,-4.7099905132,0.00041168711003,269),1)
  87. atomlocation(5,l(-648,-2161,1085,0.7,0.60928883931,-2.609987149,0.064796236593,269),1)
  88. atomlocation(4,l(3062,-2161,1064,0.7,0.61868654271,-0.51997821429,6.2167347896,269),1)
  89. atomlocation(3,l(1201,873,-2,0.7,4.712387201,62.83185308,5.9689816368,269),1)
  90. atomlocation(2,l(-963,1576,-2,1.05,0,28.27433389,1.2565882238,2316),1)
  91. atomlocation(1,l(1201,-1402,-2,1.05,6.2832,6.2832,6.2832,2316),1)
  92. commandactive("Files")
  93. viewshown("Fnt")
  94. grid(8)
  95. atom_count(10)
  96. valencelist(3,2,-6)
  97. valencelist(2,2,7)
  98. valencelist(1,2,7)
  99.