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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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94800 50003982 1 O3N4C29H40 A3B4C29D40 -134.45 8.63 -8.63 -0.13 0
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94801 50003987 1 O4N5C33H45 A4B5C33D45 -169.08 7.89 -8.93 -0.43 0
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94802 50003991 1 BrO3N4C29H39 AB3C4D29E39 -140.62 5.36 -8.79 -0.18 0
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94803 50003992 1 F3O3N4C28H35 A3B3C4D28E35 -280.92 7.34 -9.03 -0.66 0
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94804 50003994 1 O4N5C31H43 A4B5C31D43 -175.65 7.38 -8.99 -0.58 0
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94805 50003995 1 N4O5C29H40 A4B5C29D40 -199.32 5.54 -8.45 -0.32 0
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94807 50003999 1 N4O4C29H40 A4B4C29D40 -166.45 4.18 -8.4 -0.18 0
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94808 50004002 2 N2O2C14H19 A2B2C14D19 -157.86 9.19 -8.87 -0.15 0
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94809 50004008 1 N4O4C29H38 A4B4C29D38 -162.48 6.22 -8.86 -0.42 0
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94810 50004009 1 O4N5C30H41 A4B5C30D41 -159.83 9.58 -8.91 -0.16 0
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94811 50004010 1 Cl2O3N4C27H34 A2B3C4D27E34 -127.63 7.28 -8.92 -0.7 0
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94812 50004015 1 O4N5C33H45 A4B5C33D45 -170.26 3.35 -9.0 -0.26 0
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94813 50004021 1 N4O4C29H40 A4B4C29D40 -165.28 8.78 -8.77 -0.11 0
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94814 50004023 1 Cl2O3N4C27H34 A2B3C4D27E34 -139.48 9.66 -9.09 -0.52 0
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94815 50004025 1 F2O3N4C27H34 A2B3C4D27E34 -212.17 8.41 -8.76 -0.77 0
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94816 50004028 1 O3N4C29H40 A3B4C29D40 -136.29 5.99 -8.74 -0.14 0
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94817 50004029 1 F2O3N4C27H34 A2B3C4D27E34 -208.61 9.9 -8.6 -0.77 0
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94818 50004033 1 FO4N5C35H42 AB4C5D35E42 -188.06 6.55 -8.88 -0.53 0
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94819 50004040 1 BrFO3N4C27H34 ABC3D4E27F34 -160.64 9.18 -8.79 -0.72 0
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94820 50004042 1 F2O4N5C29H37 A2B4C5D29E37 -254.26 4.23 -8.89 -0.74 0
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94821 50004043 1 FO5N6C38H47 AB5C6D38E47 -238.14 8.9 -9.09 -0.49 0
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94822 50004046 1 O5N6C37H46 A5B6C37D46 -188.25 10.62 -8.7 -0.42 0
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94823 50004047 1 FO5N6C37H45 AB5C6D37E45 -235.67 7.97 -8.78 -0.64 0
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94824 50004053 1 FO5N6C38H47 AB5C6D38E47 -245.62 2.46 -8.71 -0.62 0
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94825 50004076 1 FO5N6C38H47 AB5C6D38E47 -239.9 4.57 -8.95 -0.54 0