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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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25700 629347 1 NO3C20H33 AB3C20D33 -95.26 8.62 -9.44 -0.41 0
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25701 629353 1 SN2O2H12C18 AB2C2D12E18 -20.58 4.96 -8.8 -1.15 0
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25702 629385 1 FSO2N5H12C13 ABC2D5E12F13 -23.41 9.47 -8.96 -1.5 0
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25703 629392 1 OSN3H15C18 ABC3D15E18 58.32 5.04 -9.01 -1.52 0
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25704 629406 1 SiO2C24H30 AB2C24D30 -93.51 2.99 -9.0 0.11 0
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25705 629444 2 NO2C11H12 AB2C11D12 -121.18 5.37 -8.69 -0.05 0
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25706 629451 1 ON2C23H30 AB2C23D30 -11.36 3.03 -7.97 0.24 0
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25707 629452 1 NBr2O4C11H11 AB2C4D11E11 -139.24 7.65 -9.6 -0.95 0
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25708 629453 1 OSC24H42 ABC24D42 -107.37 4.41 -8.92 -0.64 0
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25709 629454 1 OSC30H54 ABC30D54 -135.73 4.19 -8.94 -0.66 0
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25710 629513 1 O5H14C19 A5B14C19 -120.5 10.54 -9.16 -1.44 0
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25711 629522 1 N3H23C25 A3B23C25 117.9 7.59 -8.58 -0.57 0
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25712 629525 1 SCl3N3H10C14 AB3C3D10E14 78.75 3.17 -9.17 -0.94 -4
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25713 629532 1 NiN2C26H32 AB2C26D32 140.96 1.19 -6.84 -0.55 1
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25714 629533 1 IO2N6C17H18 AB2C6D17E18 64.95 8.49 0.0 0.0 0
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25715 629611 1 NH21C24 AB21C24 97.3 3.06 -8.09 -0.82 0
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25716 629614 1 O2H16C23 A2B16C23 24.88 4.54 -8.73 -1.4 0
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25717 629616 1 NO3C20H21 AB3C20D21 -89.12 4.78 -8.31 -0.47 0
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25718 629618 1 OCl2N5H11C13 AB2C5D11E13 25.06 4.83 -9.21 -1.2 0
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25719 629682 2 NO2H8C9 AB2C8D9 -77.37 5.68 -8.93 -1.52 0
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25720 629706 1 O2Cl3H7C15 A2B3C7D15 -54.59 3.74 -9.52 -1.78 0
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25721 629739 1 OSiC22H46 ABC22D46 -177.9 1.91 -9.05 1.28 0
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25722 629743 1 ClSO2N4H13C16 ABC2D4E13F16 88.85 5.64 -8.91 -1.58 0
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25723 629749 1 INO2H8C12 ABC2D8E12 61.12 5.18 -9.52 -1.1 0
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25724 629751 1 ClNPO3C15H17 ABCD3E15F17 -142.29 5.07 -8.67 0.02 0
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25725 629767 2 NOH12C15 ABC12D15 51.83 4.27 -8.8 -0.66 0
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25726 629781 1 SH18C23 AB18C23 96.65 1.21 -8.45 -0.35 0
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25727 629782 1 O4C21H24 A4B21C24 -166.03 6.7 -8.91 -0.77 0
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25728 629785 1 SiO4C19H20 AB4C19D20 -164.55 2.65 -9.24 -1.33 0
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25729 629786 1 NO2C21H27 AB2C21D27 -43.8 3.54 -8.55 -1.14 0
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25730 629787 1 O13C41H68 A13B41C68 -673.38 4.86 -9.31 0.54 0
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25731 629788 1 BrNO3C14H16 ABC3D14E16 -115.54 6.49 -8.68 -0.55 0
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25732 629790 1 N2O3H16C22 A2B3C16D22 -39.9 3.84 -8.85 -1.56 0
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25733 629791 1 IN2O2H11C14 AB2C2D11E14 62.66 3.94 -9.08 -1.67 0
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25734 629798 1 O4C31H46 A4B31C46 -206.31 3.19 -9.23 -0.24 0
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25735 629802 1 NO5C24H29 AB5C24D29 -175.61 4.08 -8.31 -0.11 0
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25736 629806 1 O7C36H50 A7B36C50 -349.35 4.92 -9.8 -0.75 0
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25737 629816 2 NO2C9H9 AB2C9D9 -103.33 2.77 -9.7 -0.94 0
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25738 629817 1 SN2H14C21 AB2C14D21 121.44 4.32 -8.51 -0.91 0
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25739 629820 1 SN2O2C18H18 AB2C2D18E18 -9.04 7.05 -8.67 -1.06 0
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25740 629828 2 NOC10H13 ABC10D13 -47.8 3.07 -8.05 0.06 0
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25741 629861 1 ON3H17C21 AB3C17D21 107.45 5.36 -8.01 -1.18 -16
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25742 629873 2 NiC8H9 AB8C9 195.32 4.77 -7.24 -1.04 0
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25743 630031 1 O5C22H26 A5B22C26 -188.21 2.25 -9.0 0.05 0
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25744 630074 1 ON2H20C22 AB2C20D22 37.08 2.01 -8.15 -0.62 0
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25745 630108 1 O5C29H44 A5B29C44 -279.0 2.5 -9.42 0.33 0
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25746 630109 1 NS2F3O4C10H10 AB2C3D4E10F10 -308.73 2.86 -8.85 -1.57 0
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25747 630111 1 IN2O2H15C18 AB2C2D15E18 3.15 4.15 -9.14 -0.83 0
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25748 630113 1 C11F14 A11B14 -649.94 2.3 -11.34 -2.2 0
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25749 630124 1 NO3C20H27 AB3C20D27 -91.69 2.67 -8.2 0.23 0
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25750 630414 2 NO2C9H12 AB2C9D12 -127.49 2.69 -8.47 -0.56 0
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25751 630415 2 NO2C9H12 AB2C9D12 -114.85 3.47 -8.67 -0.82 0
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25752 630416 2 NO2C9H12 AB2C9D12 -170.94 2.92 -9.03 -0.35 0
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25753 630485 1 ON3C21H23 AB3C21D23 33.73 2.73 -8.47 -0.42 0
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25754 630486 1 NO5C18H23 AB5C18D23 -171.33 3.59 -8.82 -0.21 -5
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25755 630489 1 NOC14H16 ABC14D16 3.95 3.13 0.0 0.0 0
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25756 630490 1 NO5C18H23 AB5C18D23 -167.45 2.8 -8.55 0.15 0
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25757 630492 1 NSO2C19H27 ABC2D19E27 -68.49 1.66 -8.05 -0.76 0
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25758 630493 1 FNOH20C22 ABCD20E22 -30.01 7.47 -8.64 -0.76 0
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25759 630494 1 ClN5C17H24 AB5C17D24 30.92 5.39 -8.74 -0.44 0
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25760 630495 1 NOF6H9C15 ABC6D9E15 -273.1 5.24 -10.26 -1.49 0
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25761 630496 1 O5C24H36 A5B24C36 -278.13 4.98 -9.94 0.18 0
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25762 630498 2 NO3C13H28 AB3C13D28 -318.75 3.63 -8.89 1.88 0
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25763 630499 1 N3O4H11C18 A3B4C11D18 -7.73 2.83 -9.44 -1.62 0
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25764 630500 1 OF3N3H14C17 AB3C3D14E17 -128.57 5.24 -8.16 -0.67 0
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25765 630501 1 BrNOCl2H8C12 ABCD2E8F12 -10.11 8.0 -9.01 -0.97 0
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25766 630503 1 Si5O7C21H50 A5B7C21D50 -581.42 1.27 -9.52 0.13 0
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25767 630504 3 FNC6H6 ABC6D6 -85.84 2.81 -8.73 -1.36 0
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25768 630509 1 NOH15C24 ABC15D24 85.78 3.86 -9.3 -1.42 0
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25769 630511 2 O2F3H4C8 A2B3C4D8 -445.77 0.37 -10.7 -1.7 0
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25770 630514 1 O5H22C23 A5B22C23 -128.26 6.51 -8.81 -0.16 0
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25771 630516 2 BrH7C10 AB7C10 64.15 2.17 -8.74 -0.98 0
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25772 630517 1 ClSO2N3H12C15 ABC2D3E12F15 36.65 8.07 -8.61 -1.5 0
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25773 630522 1 O4C23H24 A4B23C24 -86.88 2.95 -8.53 0.23 0
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25774 630523 1 N2O8F9C20H23 A2B8C9D20E23 -805.53 5.5 -10.56 -0.74 0
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25775 630526 1 N8O11C49H82 A8B11C49D82 -535.82 8.08 -9.36 0.0 0
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25776 630527 1 NiON2C30H42 ABC2D30E42 57.11 3.18 -7.24 -0.54 0
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25777 630529 1 NOC31H43 ABC31D43 -43.44 4.16 -8.55 -0.01 -10
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25779 630534 1 B3O5C17H17 A3B5C17D17 -360.33 4.89 -9.24 -0.32 0
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25780 630535 1 FO3C20H27 AB3C20D27 -211.45 4.63 -9.61 0.12 0
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25781 630536 1 N2O2C21H22 A2B2C21D22 11.08 7.87 -7.89 -0.99 0
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25782 630537 1 N2O4H14C19 A2B4C14D19 -95.99 0.41 -9.5 -1.18 0
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25783 630538 1 N2O5C17H22 A2B5C17D22 -92.99 9.81 -9.31 -1.35 0
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25784 630539 1 NCl2O4C17H17 AB2C4D17E17 -143.7 5.08 -9.2 -1.0 0
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25785 630541 1 NSi2O3C20H33 AB2C3D20E33 -212.39 6.89 -9.05 -0.96 0
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25786 630542 1 IOH11C15 ABC11D15 47.24 2.55 -9.46 -1.03 0
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25787 630543 1 N2O5H16C21 A2B5C16D21 -96.89 7.98 -9.17 -1.39 0
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25788 630544 1 ON2C22H26 AB2C22D26 -7.6 0.45 -8.74 0.37 0
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25789 630545 1 SN2O3H14C20 AB2C3D14E20 5.27 7.9 -9.77 -1.23 0
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25790 630555 1 ClO4C44H71 AB4C44D71 -259.46 1.7 -8.67 -0.05 0
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25791 630630 1 N3O4C23H25 A3B4C23D25 -53.81 3.84 -8.72 -1.26 0
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25792 630697 1 N2O3C20H20 A2B3C20D20 -53.73 2.89 -8.76 -0.61 0
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25793 630698 1 FeN4P5C7F10H21 AB4C5D7E10F21 -1011.63 6.9 -6.61 0.41 0
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25794 630866 1 ClN4O6H7C12 AB4C6D7E12 32.5 6.06 -10.17 -2.26 0
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25795 630901 1 ON2S2H18C19 AB2C2D18E19 22.4 2.15 -8.04 -1.47 0
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25796 630914 1 BrClNO2H9C14 ABCD2E9F14 1.93 2.54 -8.93 -1.08 0
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25797 630915 1 INO2H10C13 ABC2D10E13 2.22 0.73 -8.91 -0.98 0
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25798 630925 1 NC25H25 AB25C25 52.05 3.24 -8.09 -0.2 0
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25799 630956 2 NOH8C11 ABC8D11 57.19 2.06 -8.54 -1.29 0
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25800 630957 1 NO3F7H10C16 AB3C7D10E16 -422.87 5.41 -9.21 -1.12 0