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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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63701 26759003 1 ClNO5C18H18 ABC5D18E18 -167.2 6.64 -8.93 -0.86 0
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63702 26759009 1 BrNO5C18H18 ABC5D18E18 -156.51 9.94 -9.06 -0.97 0
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63703 26759011 1 NO6C19H21 AB6C19D21 -197.58 5.72 -8.19 -0.85 0
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63704 26759012 1 NO6C19H21 AB6C19D21 -197.42 9.52 -8.29 -0.86 0
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63705 26759016 1 NF3O5H18C19 AB3C5D18E19 -317.85 4.79 -8.9 -0.86 0
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63706 26759017 1 NO5C16H23 AB5C16D23 -199.02 2.05 -8.7 -0.58 0
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63707 26759019 1 NO5C16H23 AB5C16D23 -209.83 8.15 -8.91 -0.78 0
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63708 26759020 1 NO5C21H25 AB5C21D25 -176.01 8.45 -8.65 -0.86 0
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63709 26759023 1 ClFNO5H17C18 ABCD5E17F18 -214.92 9.5 -8.99 -1.01 0
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63710 26759024 1 ClFNO5H17C18 ABCD5E17F18 -211.35 8.6 -8.94 -0.96 0
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63711 26759025 1 ClFNO5H17C18 ABCD5E17F18 -207.85 7.3 -8.99 -0.9 0
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63712 26759028 1 NO6C21H25 AB6C21D25 -208.29 8.49 -8.71 -0.84 0
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63713 26759030 1 NO6C21H25 AB6C21D25 -206.38 7.04 -8.67 -0.78 0
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63714 26759031 1 FSN3O4C24H26 ABC3D4E24F26 -135.54 9.3 -8.38 -0.86 0
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63715 26759034 1 NF2O5H17C18 AB2C5D17E18 -247.49 6.13 -8.94 -0.91 0
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63716 26759037 1 SN3O4C25H29 AB3C4D25E29 -95.17 6.57 -8.26 -0.43 0
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63717 26759038 1 NF2O5H17C18 AB2C5D17E18 -249.7 5.8 -8.94 -0.85 0
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63718 26759043 1 ClNO5C19H20 ABC5D19E20 -169.95 5.62 -8.83 -0.71 0
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63719 26759044 1 NF2O5H17C18 AB2C5D17E18 -246.61 5.6 -8.9 -0.84 0
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63720 26759046 1 NF2O5H17C18 AB2C5D17E18 -251.08 9.95 -9.03 -1.02 0
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63721 26759047 1 NF2O5H17C18 AB2C5D17E18 -249.9 9.44 -9.05 -1.01 0
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63722 26759048 1 NO7C20H23 AB7C20D23 -229.04 1.53 -8.14 -0.56 0
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63723 26759049 1 NO7C20H23 AB7C20D23 -233.74 3.96 -7.98 -0.82 0
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63724 26759050 1 ClNF3O5H17C19 ABC3D5E17F19 -327.95 5.92 -8.95 -0.92 0
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63725 26759051 1 ClNF3O5H17C19 ABC3D5E17F19 -326.44 5.79 -8.95 -0.94 0
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63726 26759052 1 FNO5C19H20 ABC5D19E20 -214.85 9.25 -8.81 -0.87 0
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63727 26759053 1 FNO5C19H20 ABC5D19E20 -213.67 9.12 -8.77 -0.88 0
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63728 26759055 1 NO5C19H27 AB5C19D27 -208.39 6.47 -8.82 -0.73 0
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63729 26759057 1 NO6C20H23 AB6C20D23 -199.32 8.08 -8.82 -0.72 0
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63730 26759058 1 SF2N2O4C18H18 AB2C2D4E18F18 -208.53 7.85 -9.38 -1.27 0
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63731 26759059 1 NO6C20H23 AB6C20D23 -199.92 7.47 -8.81 -0.67 0
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63732 26759060 1 FNO5C19H20 ABC5D19E20 -208.59 9.23 -8.94 -0.83 0
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63733 26759061 1 FNO5C19H20 ABC5D19E20 -208.58 7.72 -8.89 -0.84 0
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63734 26759062 1 SN2O5C21H26 AB2C5D21E26 -167.27 10.82 -9.12 -0.58 0
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63735 26759065 1 SN2O5C22H24 AB2C5D22E24 -152.98 8.78 -9.09 -0.64 0
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63736 26759067 1 SN2O5C24H26 AB2C5D24E26 -150.8 10.71 -9.12 -0.71 0
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63737 26759069 1 NO5C20H23 AB5C20D23 -173.23 8.27 -8.94 -0.82 0
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63738 26759070 1 NO5C20H23 AB5C20D23 -172.71 4.28 -8.85 -0.81 0
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63739 26759071 1 NF2O6C19H19 AB2C6D19E19 -304.79 5.82 -8.81 -0.75 0
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63740 26759072 1 NF2O6C19H19 AB2C6D19E19 -305.05 4.63 -8.88 -0.82 0
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63741 26759073 1 SN2O5C22H24 AB2C5D22E24 -138.28 0.89 -8.74 -0.69 0
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63742 26759074 1 SN2O5C22H24 AB2C5D22E24 -142.45 7.39 -8.88 -0.91 0
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63743 26759075 1 NO5C20H23 AB5C20D23 -170.86 8.25 -8.89 -0.77 0
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63744 26759077 1 NO6C20H21 AB6C20D21 -202.32 6.66 -8.7 -0.66 0
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63745 26759079 1 SN2O6C17H18 AB2C6D17E18 -190.39 4.8 -8.82 -0.77 0
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63746 26759080 1 SN2O6C17H18 AB2C6D17E18 -204.55 6.81 -8.76 -0.71 0
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63747 26759082 1 SN4O6C22H30 AB4C6D22E30 -250.01 12.5 -9.04 -0.59 0
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63748 26759088 1 N2O5C22H26 A2B5C22D26 -149.61 5.31 -8.09 -0.74 0
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63749 26759090 1 N2O5C22H26 A2B5C22D26 -149.31 0.98 -8.39 -0.56 0
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63750 26759107 2 NO3C9H12 AB3C9D12 -244.9 2.68 -8.84 -0.74 0