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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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19735 571531 1 N5O6H9C13 A5B6C9D13 15.71 3.35 -9.73 -2.09 0
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19736 571629 1 N3O3H11C16 A3B3C11D16 5.97 5.26 -8.72 -1.57 0
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19737 571630 1 N2O2F3H11C14 A2B2C3D11E14 -182.24 7.61 -9.09 -0.89 0
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19738 571713 1 NO3H15C16 AB3C15D16 -84.94 5.44 -9.79 -0.89 0
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19739 571752 1 N2O3H16C17 A2B3C16D17 -81.25 2.1 -8.7 -0.25 0
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19740 571780 1 ON2C15H16 AB2C15D16 -6.78 3.15 -8.57 -0.09 0
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19741 571811 1 O2N3C10H11 A2B3C10D11 -23.15 6.48 -9.15 -1.14 0
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19742 571814 1 NO2C11H15 AB2C11D15 -81.77 5.67 -9.74 -0.18 0
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19743 571815 1 NO2C9H9 AB2C9D9 -21.36 3.14 -9.41 -0.13 0
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19744 571818 2 OC5H5 AB5C5 -68.75 3.05 -9.08 -0.66 0
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19745 571837 1 N2O2C9H12 A2B2C9D12 -64.36 3.65 -8.49 0.37 0
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19746 571843 1 NOC14H19 ABC14D19 -39.08 2.12 -9.28 0.33 0
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19747 571845 1 N2O2C25H26 A2B2C25D26 -23.08 2.14 -8.93 -0.56 0
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19748 571895 1 O2N3C16H17 A2B3C16D17 -24.33 4.55 -9.12 -0.32 0
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19749 571910 1 BrNSO2H12C13 ABCD2E12F13 -30.47 3.33 -9.24 -1.06 0
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19750 571943 1 ClO2C6H13 AB2C6D13 -119.96 1.86 -10.24 0.63 0
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19751 571956 1 OC12H20 AB12C20 -58.12 3.44 -9.07 0.74 0
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19752 571957 2 NO2C6H7 AB2C6D7 -158.38 2.81 -9.16 -0.15 0
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19753 571959 1 NO2C11H15 AB2C11D15 -18.36 3.13 -9.09 -0.49 0
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19754 571989 1 SN4C10H14 AB4C10D14 72.15 3.13 -9.01 -0.78 0
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19755 571990 1 SN4C10H14 AB4C10D14 74.58 2.56 -9.15 -0.74 0
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19756 571991 1 SN4C10H14 AB4C10D14 75.09 1.01 -8.97 -0.8 0
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19757 572000 1 PSO2C7H17 ABC2D7E17 -174.69 3.96 -9.43 0.06 0
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19758 572042 1 SN2O2C6H6 AB2C2D6E6 23.48 4.43 -9.02 -1.64 0
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19759 572083 1 OC16H22 AB16C22 -31.53 2.34 -9.32 0.4 0
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19760 572084 1 OC9H16 AB9C16 -70.97 2.56 -8.98 1.44 0
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19761 572085 1 NO3C13H13 AB3C13D13 -82.53 4.29 -9.67 -0.45 0
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19762 572099 1 N5O7H9C13 A5B7C9D13 39.66 5.5 -10.34 -1.99 0
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19763 572107 2 NOC12H14 ABC12D14 -13.47 0.82 -8.99 -0.06 0
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19764 572109 1 N3O4C14H17 A3B4C14D17 -160.81 7.32 -9.4 -0.4 0
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19765 572158 2 NC4H6 AB4C6 25.74 1.44 -8.77 0.08 0
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19766 572234 2 NC9H10 AB9C10 54.09 3.74 -8.64 0.06 0
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19767 572252 2 NC3H4 AB3C4 41.78 4.18 -9.26 0.62 0
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19768 572368 1 N5O7C22H25 A5B7C22D25 -88.02 8.23 -9.14 -2.2 0
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19769 572384 1 O2C21H32 A2B21C32 -121.43 1.5 -8.89 0.23 0
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19770 572396 1 ON2H16C19 AB2C16D19 77.06 2.05 -8.64 -1.01 0
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19771 572400 1 NF3O3C17H18 AB3C3D17E18 -281.61 1.04 -9.52 -0.72 0
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19772 572401 1 NO4H9C11 AB4C9D11 -124.48 1.6 -9.71 -0.61 0
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19773 572410 1 FON2H6C8 ABC2D6E8 3.09 4.14 0.0 0.0 1
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19774 572433 1 SO2N3H15C16 AB2C3D15E16 -25.97 3.44 -8.92 -1.52 0
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19775 572474 1 ON4C11H12 AB4C11D12 7.17 3.32 -8.7 -0.38 0
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19776 572490 1 NO2C15H21 AB2C15D21 -97.4 3.5 -8.72 0.05 0
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19777 572494 1 O2N3F6C11H11 A2B3C6D11E11 -350.7 5.57 -9.3 -0.48 0
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19778 572531 1 O3N4C10H12 A3B4C10D12 -22.96 7.47 -8.85 -0.88 0
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19779 572532 1 ClSO2N4C5H5 ABC2D4E5F5 24.75 1.46 -9.7 -1.66 0
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19780 572538 1 ON2C12H18 AB2C12D18 -42.45 1.93 -9.11 -0.15 0
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19781 572586 1 FOSN3H10C11 ABCD3E10F11 -1.74 4.3 -9.38 -1.14 0
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19782 572598 1 SN3C13H13 AB3C13D13 92.14 0.97 -8.72 -0.6 0
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19783 572614 1 ClON2F3H10C16 ABC2D3E10F16 -128.46 4.99 -9.83 -1.59 0
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19784 572650 1 O5C17H22 A5B17C22 -193.54 6.01 -9.59 -0.45 0
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19785 572721 1 ON3C7H11 AB3C7D11 -10.4 1.89 -9.05 -0.13 0
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19786 572723 1 ON3C14H15 AB3C14D15 12.03 4.2 -9.34 0.2 0
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19787 572740 1 ClNO3C16H16 ABC3D16E16 -92.61 2.74 -8.88 -0.33 0
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19788 572742 2 OC10H18 AB10C18 -108.31 0.4 -9.48 1.23 0
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19789 572791 1 NO5C11H15 AB5C11D15 -212.99 2.5 -10.13 -0.4 0
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19790 572800 1 SO5H20C24 AB5C20D24 -122.66 3.51 -8.88 -1.17 0
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19791 572806 1 O2N5C13H13 A2B5C13D13 2.82 4.96 -9.0 -1.06 0
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19792 572831 1 NO2F6H9C15 AB2C6D9E15 -347.26 3.88 -9.41 -1.73 0
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19793 572832 1 ClON2H17C22 ABC2D17E22 44.02 4.68 -9.05 -0.91 0
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19794 572837 1 N3O5C23H29 A3B5C23D29 -79.61 5.71 -9.56 -2.12 0
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19795 572841 1 SO2H10C13 AB2C10D13 -26.78 3.87 -9.41 -0.99 0
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19796 572869 1 OC11H18 AB11C18 -59.47 3.57 -9.78 0.71 0
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19797 572916 1 BrN2O2H5C6 AB2C2D5E6 16.9 4.89 -10.94 -1.55 0
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19798 572996 1 SO4C11H20 AB4C11D20 -208.08 4.91 -10.4 0.12 0
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19799 573008 1 OC19H30 AB19C30 -62.91 2.66 -9.72 2.15 0
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19800 573025 1 N2C9H16 A2B9C16 18.8 4.35 -10.09 0.5 0
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19801 573034 1 PO2C23H45 AB2C23D45 -210.29 1.96 -8.4 1.66 0
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19802 573035 1 SiBr3C9H13 AB3C9D13 25.39 3.18 -9.87 -0.75 0
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19803 573069 1 NOC9H13 ABC9D13 1.04 3.65 -8.98 -0.5 0
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19804 573102 1 ClGeC7H13 ABC7D13 -47.44 3.2 -9.25 -0.01 0
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19805 573115 1 OC15H24 AB15C24 -62.03 1.65 -8.87 1.27 0
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19806 573159 1 SiC7H12 AB7C12 -7.95 0.86 -8.76 0.48 0
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19807 573215 1 ClO2C10H17 AB2C10D17 -130.91 2.4 -10.6 0.72 0
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19808 573216 1 OC19H24 AB19C24 -41.2 2.93 -8.85 0.1 0
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19809 573232 1 BrN3O3H10C12 AB3C3D10E12 -68.8 6.48 -9.26 -1.37 0
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19810 573235 1 SC9H16 AB9C16 -33.73 2.65 -8.47 0.75 0
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19811 573237 1 N2F4C19H20 A2B4C19D20 -155.74 5.6 -8.86 -0.52 0
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19812 573255 1 FSN2H15C16 ABC2D15E16 21.64 2.26 -8.43 -0.3 0
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19813 573283 1 BrC3Cl3H4 AB3C3D4 -36.2 0.54 -10.92 -0.78 0
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19814 573290 1 NOC13H15 ABC13D15 -9.1 3.68 -8.7 0.02 0
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19815 573347 1 IO3N4C13H13 AB3C4D13E13 -5.78 7.23 -8.4 -0.75 0
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19816 573349 1 FNOH12C18 ABCD12E18 -9.14 3.35 -8.83 -1.22 0
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19817 573382 1 N2O2C21H28 A2B2C21D28 -25.28 2.76 -8.36 0.34 0
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19818 573395 1 BrCl2O2C5H7 AB2C2D5E7 -104.2 2.56 -10.92 -1.51 0
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19819 573421 1 NO2C10H17 AB2C10D17 -106.25 2.27 -8.94 0.71 0
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19820 573436 1 BO3C22H33 AB3C22D33 -97.88 2.25 -8.43 0.35 0
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19821 573463 1 ClO3C14H19 AB3C14D19 -134.35 1.07 -8.98 -0.1 0
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19822 573472 1 NC8H15 AB8C15 -10.23 1.33 -8.23 1.47 0
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19823 573473 1 NOSC7H9 ABCD7E9 -10.85 3.26 -9.51 -1.1 0
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19824 573474 1 N2O2C13H20 A2B2C13D20 -53.2 2.35 -9.0 -0.65 0
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19825 573522 1 PO4C6H15 AB4C6D15 -246.66 1.02 -10.38 0.89 0
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19826 573539 1 O3C16H22 A3B16C22 -130.39 3.32 -8.52 0.18 0
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19827 573543 1 N4Cl5C18H19 A4B5C18D19 19.87 3.63 -9.12 -1.2 0
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19828 573577 1 NC10H21 AB10C21 -33.26 1.96 -9.1 3.68 0
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19829 573590 1 O2N3C9H15 A2B3C9D15 -68.09 1.51 -9.43 0.26 0
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19830 573591 1 Cl2O3C11H12 A2B3C11D12 -115.03 3.03 -9.13 -0.89 0
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19831 573601 1 OC9H14 AB9C14 -55.6 1.14 -8.31 1.66 0
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19832 573618 1 BrClOSC14H16 ABCDE14F16 -24.3 2.2 -8.76 -0.47 0
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19833 573671 1 BrO3C18H21 AB3C18D21 -118.8 2.95 -9.76 -0.52 0
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19834 573684 2 OC6H9 AB6C9 -82.73 1.69 -8.62 0.51 0