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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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95081 50006171 2 N3O3C20H29 A3B3C20D29 -286.45 7.42 -8.21 -0.18 0
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95082 50006172 1 N5O5C34H45 A5B5C34D45 -210.04 10.31 -8.71 -0.49 0
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95083 50006183 1 FO4N5C32H42 AB4C5D32E42 -217.26 3.26 -8.93 -0.24 0
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95084 50006185 1 ClO5N6C35H47 AB5C6D35E47 -216.39 5.15 -9.1 -0.42 0
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95085 50006198 1 ClO5N6C40H49 AB5C6D40E49 -194.38 2.36 -8.57 -0.58 0
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95086 50006199 1 O5N6C35H48 A5B6C35D48 -228.05 10.56 -8.21 -0.08 0
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95087 50006225 1 O5N6C39H54 A5B6C39D54 -229.39 7.32 -8.94 -0.23 0
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95088 50006239 1 O5N6C36H50 A5B6C36D50 -204.48 12.11 -9.23 -0.7 0
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95089 50006264 1 O5N6C39H54 A5B6C39D54 -216.84 6.4 -8.88 -0.54 0
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95090 50006266 1 O5N6C38H52 A5B6C38D52 -223.05 2.13 -8.93 -0.25 0
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95091 50006301 1 ClO5N6C40H51 AB5C6D40E51 -208.73 7.47 -8.75 -0.68 0
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95092 50006318 1 FO5N6C40H49 AB5C6D40E49 -237.39 7.76 -8.88 -0.55 0
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95093 50006339 2 N3O3C20H25 A3B3C20D25 -216.36 7.72 -8.23 -0.41 0
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95094 50006340 1 FN6O6C40H49 AB6C6D40E49 -259.63 5.25 -8.51 -0.78 0
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95095 50006343 1 FO5N6C40H51 AB5C6D40E51 -249.6 10.16 -8.79 -0.51 0
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95096 50006344 1 FO5N6C39H49 AB5C6D39E49 -233.35 4.28 -8.85 -0.45 0
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95097 50006351 1 FO5N6C34H47 AB5C6D34E47 -279.25 7.92 -8.76 -0.3 0
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95098 50006354 1 O5N6C36H50 A5B6C36D50 -231.56 8.78 -8.88 -0.4 0
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95099 50006361 1 N6O6C37H50 A6B6C37D50 -241.03 6.44 -9.01 -0.65 0
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95100 50006362 1 O5N6C38H52 A5B6C38D52 -228.14 1.9 -8.9 -0.38 0
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95101 50006374 1 ClN6O6C37H49 AB6C6D37E49 -252.08 11.59 -8.56 -1.01 0
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95102 50006392 1 FO5N6C40H51 AB5C6D40E51 -253.13 5.09 -8.79 -0.46 0
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95103 50006393 1 FO5N6C40H51 AB5C6D40E51 -250.0 10.78 -8.69 -0.22 0
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95104 50006395 1 FO5N6C39H49 AB5C6D39E49 -238.63 7.23 -8.95 -0.59 0
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95105 50006399 1 O5N6C37H52 A5B6C37D52 -226.28 6.37 -8.89 -0.75 0