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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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94670 50003090 1 ClO5N6C37H49 AB5C6D37E49 -221.85 8.28 -9.0 -0.51 0
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94671 50003093 1 FO5N6C36H51 AB5C6D36E51 -287.46 10.88 -8.65 -0.24 0
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94672 50003097 1 ClO5N6C39H49 AB5C6D39E49 -207.9 7.53 -8.71 -0.87 0
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94673 50003098 1 ClO5N6C39H49 AB5C6D39E49 -202.59 6.03 -8.66 -0.47 0
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94674 50003116 1 O5N6C38H54 A5B6C38D54 -242.75 5.22 -8.85 -0.53 0
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94675 50003128 1 F2O5N6C39H48 A2B5C6D39E48 -280.59 10.45 -8.75 -1.2 0
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94676 50003182 1 FO4N5C32H42 AB4C5D32E42 -223.77 9.08 -8.73 -0.11 0
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94677 50003200 1 O5N6C35H50 A5B6C35D50 -221.87 7.97 -8.92 -0.41 0
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94678 50003221 1 O5N6C37H50 A5B6C37D50 -222.41 3.52 -8.85 -0.21 0
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94679 50003246 1 ClO5N6C38H53 AB5C6D38E53 -223.75 9.42 -8.82 -0.87 0
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94680 50003249 1 ClO5N6C36H49 AB5C6D36E49 -234.81 3.79 -8.94 -0.6 0
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94681 50003269 1 F2O5N6C39H48 A2B5C6D39E48 -286.91 4.53 -8.92 -0.46 0
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94682 50003281 1 ClO5N6C38H47 AB5C6D38E47 -199.23 8.97 -8.86 -1.18 0
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94683 50003282 1 ClO5N6C39H49 AB5C6D39E49 -209.18 8.92 -9.01 -1.04 0
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94684 50003286 1 O5N6C39H50 A5B6C39D50 -199.2 4.79 -8.35 -0.38 0
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94685 50003288 1 O5N6C39H50 A5B6C39D50 -196.9 5.39 -8.85 -0.53 0
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94686 50003289 1 BrO4N5C31H40 AB4C5D31E40 -163.11 6.29 -8.86 -0.28 0
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94687 50003299 1 O5N6C37H50 A5B6C37D50 -215.85 2.79 -8.96 -0.44 0
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94688 50003300 1 O5N6C38H52 A5B6C38D52 -221.64 5.88 -8.95 -0.27 0
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94689 50003301 6 NOC6H8 ABC6D8 -246.51 4.7 -9.04 -0.38 0
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94690 50003302 1 O5N6C37H50 A5B6C37D50 -220.31 8.01 -8.96 -0.54 0
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94691 50003308 1 FO5N6C40H51 AB5C6D40E51 -252.15 5.63 -8.9 -0.62 0
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94692 50003325 1 ClO5N6C38H47 AB5C6D38E47 -200.68 9.79 -8.43 -0.71 0
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94693 50003328 1 ClO4N5C31H40 AB4C5D31E40 -170.59 10.72 -8.79 -0.29 0
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94694 50003342 1 ClN6O6C36H49 AB6C6D36E49 -259.88 5.67 -9.11 -0.6 0