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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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40753 8144646 1 SO2N4C22H26 AB2C4D22E26 13.49 3.31 -8.41 -0.44 0
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40754 8144648 1 ClSO2N4C20H21 ABC2D4E20F21 16.89 5.84 -8.44 -0.8 1
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40755 8144649 1 N3O3C22H22 A3B3C22D22 20.12 7.36 0.0 0.0 1
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40756 8144652 1 OS2N4C13H19 AB2C4D13E19 52.2 5.17 0.0 0.0 0
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40757 8144653 1 OS2N4C13H18 AB2C4D13E18 36.23 4.17 -8.33 -0.54 0
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40758 8144655 1 ClSO2N4C17H21 ABC2D4E17F21 12.18 5.28 -8.41 -0.4 0
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40759 8144656 1 N2O2C27H28 A2B2C27D28 21.54 3.76 -9.06 -0.05 0
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40760 8144657 1 N2O2C27H28 A2B2C27D28 21.54 4.95 -8.9 -0.22 1
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40761 8144661 1 FSO2N4C18H24 ABC2D4E18F24 -39.53 3.69 0.0 0.0 0
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40762 8144662 1 FSO2N4C18H23 ABC2D4E18F23 -60.81 2.45 -8.37 -0.6 1
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40763 8144664 1 FSO2N4C18H24 ABC2D4E18F24 -42.8 3.98 0.0 0.0 0
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40764 8144665 1 FSO2N4C18H23 ABC2D4E18F23 -64.54 2.93 -8.41 -0.69 1
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40765 8144667 1 SO2N5C22H24 AB2C5D22E24 39.37 4.45 0.0 0.0 0
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40766 8144668 1 SO2N5C22H23 AB2C5D22E23 22.04 1.2 -8.56 -1.16 1
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40767 8144669 1 OSN4C21H25 ABC4D21E25 68.51 5.33 0.0 0.0 0
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40768 8144670 1 OSN4C21H24 ABC4D21E24 49.34 4.23 -8.3 -0.26 1
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40769 8144671 1 FOSN4C20H22 ABCD4E20F22 30.5 3.43 0.0 0.0 1
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40770 8144673 1 OSN4C15H21 ABC4D15E21 40.3 5.94 0.0 0.0 1
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40771 8144675 1 OSCl2N4C17H23 ABC2D4E17F23 18.47 3.85 0.0 0.0 0
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40772 8144676 1 OSCl2N4C17H22 ABC2D4E17F22 0.22 3.46 -8.38 -1.11 1
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40773 8144677 1 S2O3N4C19H29 A2B3C4D19E29 -73.64 2.67 0.0 0.0 0
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40774 8144678 1 S2O3N4C19H28 A2B3C4D19E28 -89.65 3.3 -8.52 -1.01 0
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40775 8144681 1 ClN3O3H14C22 AB3C3D14E22 76.79 10.48 -9.3 -1.87 0
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40776 8144683 1 SO2N5C21H21 AB2C5D21E21 33.14 0.95 -8.59 -1.18 1
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40777 8144684 1 O2S2N4C12H17 A2B2C4D12E17 15.24 5.26 0.0 0.0 1
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40778 8144688 1 SN3O4C15H20 AB3C4D15E20 -64.47 4.11 0.0 0.0 0
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40779 8144689 1 SN3O4C15H19 AB3C4D15E19 -81.92 5.18 -8.83 -0.98 1
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40780 8144690 1 S2O3N4C18H29 A2B3C4D18E29 -71.58 3.07 0.0 0.0 0
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40781 8144691 1 S2O3N4C18H28 A2B3C4D18E28 -89.91 4.33 -8.52 -1.06 1
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40782 8144692 1 O2N4C12H15 A2B4C12D15 -20.23 5.79 0.0 0.0 0
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40783 8144693 2 ON2C6H7 AB2C6D7 -36.77 7.2 -9.41 -0.8 1
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40784 8144694 1 SO2N5C18H24 AB2C5D18E24 7.96 3.72 0.0 0.0 0
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40785 8144695 1 SO2N5C18H23 AB2C5D18E23 -9.16 1.07 -8.59 -1.16 1
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40786 8144696 1 SO2N5C19H26 AB2C5D19E26 3.62 11.05 0.0 0.0 0
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40787 8144697 1 SO2N5C19H25 AB2C5D19E25 -14.87 1.16 -8.58 -1.14 1
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40788 8144698 1 OS2N4C10H17 AB2C4D10E17 19.25 3.92 0.0 0.0 1
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40789 8144700 1 SO2N4C14H19 AB2C4D14E19 -49.18 4.44 0.0 0.0 0
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40790 8144701 1 SO2N4C14H18 AB2C4D14E18 -62.3 2.06 -8.78 -1.08 0
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40791 8144703 1 SN3O3C15H19 AB3C3D15E19 -46.9 5.1 -8.84 -0.43 0
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40792 8144704 1 FO2N4H15C16 AB2C4D15E16 -50.03 9.33 -9.42 -0.66 1
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40793 8144705 1 OSN4C14H19 ABC4D14E19 52.48 4.98 0.0 0.0 0
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40794 8144706 1 OSN4C14H18 ABC4D14E18 33.71 3.44 -8.42 -0.27 1
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40795 8144710 1 OSN4C15H21 ABC4D15E21 41.45 4.58 0.0 0.0 0
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40796 8144711 1 OSN4C15H20 ABC4D15E20 23.08 4.62 -8.29 -0.21 1
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40797 8144712 1 SO2N4C20H27 AB2C4D20E27 -14.92 5.42 0.0 0.0 1
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40798 8144714 1 SO2N4C13H17 AB2C4D13E17 -32.95 4.45 0.0 0.0 0
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40799 8144715 1 SO2N4C13H16 AB2C4D13E16 -46.86 1.95 -8.77 -1.17 0
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40800 8144717 1 O2N3C19H27 A2B3C19D27 -85.08 2.03 -9.02 0.18 1
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40801 8144718 1 O2N3C19H28 A2B3C19D28 -62.66 1.94 0.0 0.0 1
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40802 8144721 1 NO3C20H24 AB3C20D24 -59.78 4.74 0.0 0.0 1