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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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36752 8012208 1 FOSN4C16H21 ABCD4E16F21 -39.63 7.65 -9.01 -0.76 0
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36753 8012224 1 ClSN2O4C19H23 ABC2D4E19F23 -161.54 3.97 -8.8 -0.84 0
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36754 8012234 1 FO5H13C16 AB5C13D16 -185.54 0.87 -8.98 -0.82 0
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36755 8012235 1 NSO7H13C17 ABC7D13E17 -205.54 6.32 -9.0 -1.38 0
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36756 8012237 1 BrO6H15C17 AB6C15D17 -173.02 2.95 -8.49 -0.89 0
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36757 8012257 1 BrSO2N4H13C16 ABC2D4E13F16 53.52 4.64 -9.36 -1.21 0
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36758 8012293 1 O2N5H21C24 A2B5C21D24 84.3 8.42 -8.99 -0.85 0
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36759 8012305 1 F2N4O4H14C15 A2B4C4D14E15 -228.14 2.39 -10.12 -0.94 0
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36760 8012307 1 O2N3H25C27 A2B3C25D27 26.12 5.63 -8.4 -0.38 0
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36761 8012313 1 SCl2N2O3H12C17 AB2C2D3E12F17 -33.08 3.35 -8.83 -1.35 0
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36762 8012365 1 ClO6H13C19 AB6C13D19 -180.69 6.22 -9.36 -1.33 0
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36763 8012376 1 S2N3O3C14H17 A2B3C3D14E17 -68.36 2.87 -9.6 -0.99 0
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36764 8012410 1 FOS2N4C11H11 ABC2D4E11F11 -15.31 5.37 -8.81 -1.29 0
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36765 8012416 1 O2S2N3C20H21 A2B2C3D20E21 -31.19 1.75 -8.94 -0.92 0
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36766 8012417 1 N2O3H14C17 A2B3C14D17 -31.67 6.26 -9.44 -1.13 0
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36767 8012418 1 SN3O3C19H27 AB3C3D19E27 -122.2 2.12 -8.94 -0.81 0
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36768 8012421 1 ClSN2O4C13H13 ABC2D4E13F13 -143.34 5.35 -8.76 -0.86 0
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36769 8012462 1 SN2O3C21H22 AB2C3D21E22 -68.37 5.63 -8.9 -0.68 2
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36770 8012493 1 O2N3C22H31 A2B3C22D31 -41.12 4.17 -8.55 -0.11 0
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36771 8012523 1 ClN3O5H18C20 AB3C5D18E20 -72.42 3.75 -9.87 -1.91 0
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36772 8012526 1 NO5C14H15 AB5C14D15 -155.18 4.08 -9.37 -1.13 0
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36773 8012535 1 SO3N4H16C17 AB3C4D16E17 22.97 3.56 -8.84 -1.04 0
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36774 8012541 1 NSO5C19H21 ABC5D19E21 -163.84 5.03 -8.82 -0.51 0
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36775 8012547 1 SN2O3C21H26 AB2C3D21E26 -104.54 2.82 -8.95 -0.19 0
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36776 8012558 1 NO5C21H23 AB5C21D23 -168.88 5.04 -8.65 -1.17 0
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36777 8012586 1 NO5C18H23 AB5C18D23 -200.5 3.51 -9.31 -1.03 0
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36778 8012591 1 FO6H17C23 AB6C17D23 -195.33 3.7 -9.15 -0.81 0
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36779 8012608 1 SN4H18C20 AB4C18D20 145.34 5.93 -9.02 -0.69 0
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36780 8012611 1 SN4H18C20 AB4C18D20 145.89 4.91 -9.15 -0.78 2
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36781 8012631 3 NOC8H11 ABC8D11 -42.24 8.32 -6.98 -0.59 0
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36782 8012633 1 O6H14C17 A6B14C17 -168.67 2.26 -9.08 -0.75 0
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36783 8012639 1 ON2S2H20C24 AB2C2D20E24 74.09 5.31 -8.83 -0.68 0
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36784 8012658 1 SO3N4C16H24 AB3C4D16E24 -102.35 3.13 -9.48 -0.91 0
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36785 8012659 1 NO5H17C20 AB5C17D20 -131.3 3.29 -8.74 -0.81 0
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36786 8012701 1 N3O4C21H29 A3B4C21D29 -170.17 2.15 -8.77 0.02 0
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36787 8012707 1 SN2O5C21H24 AB2C5D21E24 -162.9 8.32 -8.41 -0.77 0
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36788 8012708 1 SN2O5C21H24 AB2C5D21E24 -163.09 9.1 -8.28 -0.75 0
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36789 8012709 1 N2O3H16C19 A2B3C16D19 -30.87 3.19 -9.0 -1.36 0
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36790 8012721 1 O2F3N4C17H19 A2B3C4D17E19 -181.24 3.82 -9.09 -0.78 0
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36791 8012749 1 SN2O3C19H20 AB2C3D19E20 -84.06 2.93 -8.77 -0.66 0
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36792 8012761 1 N3O4H21C22 A3B4C21D22 -45.18 5.14 -9.38 -1.81 0
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36793 8012771 2 ON3C10H10 AB3C10D10 52.49 3.94 -9.27 -0.79 0
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36794 8012772 1 ON2F3H11C12 AB2C3D11E12 -173.67 5.93 -8.83 -0.33 0
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36795 8012799 1 NSO7C19H19 ABC7D19E19 -216.17 6.37 -9.25 -0.93 0
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36796 8012861 1 N3O3H15C17 A3B3C15D17 -46.95 0.92 -8.57 -1.23 0
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36797 8012882 1 N2O5C22H22 A2B5C22D22 -120.62 2.55 -9.15 -0.68 1
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36798 8012884 1 O2N3C21H28 A2B3C21D28 -17.46 4.09 0.0 0.0 0
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36799 8012886 1 N2O6C21H22 A2B6C21D22 -194.61 6.21 -9.06 -1.3 0
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36800 8012888 2 NO3C10H10 AB3C10D10 -194.73 3.1 -9.2 -1.07 0
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36801 8012890 1 SCl2N2O3H14C16 AB2C2D3E14F16 -82.44 3.54 -9.02 -1.35 0
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36802 8012892 1 ClNSO4H12C18 ABCD4E12F18 -68.99 3.31 -9.2 -0.89 0
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36803 8012894 1 ClNSO3C21H22 ABCD3E21F22 -106.87 6.8 -9.07 -1.17 0
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36804 8012895 1 N3O3C22H23 A3B3C22D23 -82.33 3.49 -9.42 -0.04 0
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36805 8012950 1 ClSN2O3C17H19 ABC2D3E17F19 -97.72 7.34 -9.19 -1.39 0
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36806 8012955 1 ClSN2O3C18H21 ABC2D3E18F21 -104.3 7.22 -9.07 -1.3 0
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36807 8012958 1 N2O5C18H20 A2B5C18D20 -144.55 3.22 -9.16 -0.86 0
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36808 8012959 1 ClSN2O3C18H21 ABC2D3E18F21 -105.23 8.78 -8.88 -1.31 0
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36809 8013046 1 OS2N3H15C18 AB2C3D15E18 66.73 5.47 -8.74 -0.97 0
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36810 8013057 1 N2S2O3F4H8C15 A2B2C3D4E8F15 -214.08 5.13 -9.62 -1.98 0
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36811 8013058 1 O3N4C21H22 A3B4C21D22 -49.83 2.11 -8.78 -0.39 0
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36812 8013187 1 SN2O3C19H20 AB2C3D19E20 -63.49 5.65 -8.91 -0.5 0
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36813 8013189 1 FO6C18H19 AB6C18D19 -231.29 2.98 -8.4 -0.51 0
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36814 8013213 1 O3N4C12H12 A3B4C12D12 -80.81 4.99 -9.52 -1.42 0
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36815 8013222 1 ClSN4O4H9C13 ABC4D4E9F13 2.5 4.97 -9.18 -2.06 0
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36816 8013228 1 ClSN2O4C19H19 ABC2D4E19F19 -125.04 4.35 -8.86 -1.35 0
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36817 8013251 1 SN4O4C18H28 AB4C4D18E28 -77.4 8.34 -9.03 -1.08 0
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36818 8013255 1 O2N3H19C21 A2B3C19D21 17.74 2.76 -9.38 -0.96 0
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36819 8013311 1 ClSN2O3C18H21 ABC2D3E18F21 -87.35 4.97 -8.92 -0.9 0
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36820 8013313 1 NO6C22H25 AB6C22D25 -196.16 5.44 -8.73 -0.72 0
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36821 8013318 1 NO6C22H25 AB6C22D25 -197.54 3.41 -8.54 -0.69 0
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36822 8013331 2 O4H9C10 A4B9C10 -254.57 4.69 -8.65 -1.23 0
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36823 8013363 1 N2O7C20H28 A2B7C20D28 -288.53 3.39 -9.04 -0.96 0
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36824 8013365 1 N2O7C20H28 A2B7C20D28 -278.04 6.68 -8.64 -0.95 0
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36825 8013371 1 N2O7C16H22 A2B7C16D22 -270.42 6.48 -9.0 -0.82 0
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36826 8013376 1 NO6C22H27 AB6C22D27 -212.71 7.1 -8.6 -0.85 0
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36827 8013382 1 N2O3C21H28 A2B3C21D28 -91.86 2.52 -7.73 0.07 0
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36828 8013383 1 NCl2O6H13C17 AB2C6D13E17 -147.36 6.71 -9.84 -1.29 0
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36829 8013413 1 NO6C23H27 AB6C23D27 -210.34 6.55 -9.09 -0.86 0
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36830 8013436 1 Cl2O5H12C17 A2B5C12D17 -150.67 1.93 -9.15 -0.92 0
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36831 8013465 1 Cl2N2O5H12C15 A2B2C5D12E15 -144.7 1.29 -9.66 -0.66 0
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36832 8013466 2 NO4C10H13 AB4C10D13 -311.36 4.29 -9.01 -0.95 0
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36833 8013469 1 NCl2O3C17H17 AB2C3D17E17 -112.87 4.95 -8.78 -0.34 0
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36834 8013471 1 NCl2O4H17C19 AB2C4D17E19 -145.65 4.81 -9.17 -0.7 0
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36835 8013523 1 N2F3O6H13C17 A2B3C6D13E17 -290.23 4.9 -9.42 -2.19 0
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36836 8013525 1 NO8C21H23 AB8C21D23 -271.97 4.34 -8.69 -0.99 0
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36837 8013527 1 Cl2N2O3H14C18 A2B2C3D14E18 -75.9 2.35 -9.26 -0.77 0
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36838 8013568 2 NO4C10H11 AB4C10D11 -210.42 7.19 -9.03 -1.32 0
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36839 8013596 1 Cl2N2O3H12C17 A2B2C3D12E17 -68.78 8.97 -9.35 -0.98 0
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36840 8013599 1 N2O6H18C19 A2B6C18D19 -111.51 5.88 -8.69 -0.93 0
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36841 8013607 1 NSO8C18H25 ABC8D18E25 -319.21 6.45 -8.91 -0.15 0
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36842 8013643 1 NCl2O4H19C20 AB2C4D19E20 -152.06 2.05 -9.55 -0.57 0
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36843 8013644 1 FNO6C20H22 ABC6D20E22 -251.9 3.07 -8.82 -0.28 0
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36844 8013672 1 NO6C14H19 AB6C14D19 -222.58 3.58 -8.67 -0.08 0
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36845 8013676 1 N2O6C19H26 A2B6C19D26 -212.83 8.5 -8.91 -0.09 0
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36846 8013716 1 NO6C14H19 AB6C14D19 -229.01 4.71 -8.8 0.02 0
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36847 8013726 1 ON2C19H24 AB2C19D24 -20.71 0.85 -9.27 -0.92 0
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36848 8013736 1 NO6C24H31 AB6C24D31 -228.72 2.95 -8.85 -0.14 0
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36849 8013746 1 SN2F3O3H15C19 AB2C3D3E15F19 -210.73 4.6 -9.12 -0.97 0
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36850 8013748 1 FNO6C22H26 ABC6D22E26 -260.57 2.75 -8.9 -0.16 0
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36851 8013750 1 ClN2O6C19H21 AB2C6D19E21 -196.48 5.9 -8.9 -0.59 0