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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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228761 87565692 1 FSN2O2C20H21 ABC2D2E20F21 -31.09 4.23 -9.12 -0.7 0
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228762 87565693 1 S2N3F6O6H21C31 A2B3C6D6E21F31 -427.79 11.99 -8.81 -1.54 0
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228763 87565697 1 O6C7H12 A6B7C12 -265.43 5.64 -10.76 -0.5 0
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228764 87565703 1 SF3N3O5C18H24 AB3C3D5E18F24 -338.73 3.41 -8.92 -0.71 0
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228765 87565704 1 SN3O3C16H23 AB3C3D16E23 -99.81 2.73 -8.85 -0.17 0
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228766 87565705 1 SF2N2O2C18H18 AB2C2D2E18F18 -82.06 4.2 -9.01 -1.46 0
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228767 87565714 1 FSN3O4C27H32 ABC3D4E27F32 -129.6 4.26 -8.8 -0.26 0
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228768 87565717 2 O3C5H11 A3B5C11 -293.7 4.22 -9.98 0.51 0
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228769 87565719 1 N2O2F7H25C27 A2B2C7D25E27 -400.04 8.91 -9.62 -0.95 0
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228770 87565726 1 SCl2O2N3C9H9 AB2C2D3E9F9 -37.32 1.36 -9.01 -0.7 0
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228771 87565729 1 NPS2O3C8H14 ABC2D3E8F14 -163.28 2.82 -9.54 -0.6 1
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228772 87565735 1 S2N3O5F6H14C19 A2B3C5D6E14F19 -425.56 8.16 0.0 0.0 0
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228773 87565736 2 O4C8H17 A4B8C17 -393.56 4.78 -9.63 0.61 -1
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228774 87565739 1 N2O5C10H11 A2B5C10D11 -106.01 2.07 0.0 0.0 1
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228775 87565742 1 N2O5C10H13 A2B5C10D13 -140.51 3.97 0.0 0.0 0
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228776 87565747 1 SCl2O4H8C9 AB2C4D8E9 -127.72 3.24 -10.31 -1.47 0
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228777 87565750 2 H5C6 A5B6 126.82 1.37 -8.62 -0.52 0
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228778 87565762 1 O9C12H22 A9B12C22 -428.96 5.37 -10.48 -0.24 0
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228779 87565763 1 O9C20H40 A9B20C40 -452.8 8.76 -9.8 -0.29 0
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228780 87565764 1 ClFSN3O3C26H31 ABCD3E3F26G31 -104.91 7.63 -8.87 -0.32 0
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228781 87565765 1 FSN3O3C26H30 ABC3D3E26F30 -75.79 3.76 -8.9 -0.27 0
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228782 87565767 2 BrNO2H16C18 ABC2D16E18 -116.72 0.6 -9.41 -2.81 0
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228783 87565770 1 OCl2C6H12 AB2C6D12 -60.06 2.67 -10.14 -0.22 0
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228784 87565774 1 NTiCl2C14H25 ABC2D14E25 94.16 10.36 -6.78 -1.36 0
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228785 87565782 2 O4C7H16 A4B7C16 -366.28 2.78 -9.73 1.58 0
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228786 87565783 1 FS2O4N6H19C23 AB2C4D6E19F23 -18.74 6.38 -8.74 -1.34 0
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228787 87565784 1 SF3N3O5C18H24 AB3C3D5E18F24 -333.82 4.27 -8.78 -0.97 0
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228788 87565785 1 SN3O3C16H23 AB3C3D16E23 -97.84 2.36 -8.9 -0.1 0
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228789 87565786 1 N3O3C28H45 A3B3C28D45 -170.36 2.79 -8.63 -0.27 0
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228790 87565787 1 N3O3C28H45 A3B3C28D45 -167.88 4.81 -8.61 -0.16 0
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228791 87565790 1 O8C9H18 A8B9C18 -363.54 4.66 -10.13 -0.07 0
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228792 87565791 1 N3O3C23H27 A3B3C23D27 -3.76 5.02 -8.72 -1.2 0
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228793 87565793 1 FSN3O4C26H30 ABC3D4E26F30 -121.29 3.95 -8.6 -0.24 0
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228794 87565795 1 NO2C10H17 AB2C10D17 -69.98 3.46 -8.31 -0.08 0
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228795 87565805 2 OH14C17 AB14C17 46.27 0.65 -7.7 -1.33 0
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228796 87565808 1 ClFSO3N4C22H26 ABCD3E4F22G26 -104.38 8.86 -9.38 -0.92 0
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228797 87565810 1 O9C12H22 A9B12C22 -426.39 6.2 -9.98 -0.59 0
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228798 87565811 1 P2N4O27C69H94 A2B4C27D69E94 -1273.9 9.92 -9.35 -0.35 0
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228799 87565819 1 FOSN3C21H24 ABCD3E21F24 7.12 4.01 -8.55 -0.28 0
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228800 87565820 1 ON2S2C6H12 AB2C2D6E12 7.61 3.54 -8.45 -0.9 0
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228801 87565831 1 ClFSN3O5C28H35 ABCD3E5F28G35 -203.48 4.98 -8.74 -0.18 0
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228802 87565836 1 ClNOC13H26 ABCD13E26 -62.08 19.48 -7.35 -1.07 0
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228803 87565839 1 NSO2C12H15 ABC2D12E15 -46.27 3.44 -8.92 -0.13 1
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228804 87565841 1 N2O2C17H27 A2B2C17D27 -30.97 9.43 0.0 0.0 0
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228805 87565847 1 SiO4C8H15 AB4C8D15 -224.19 3.71 0.0 0.0 0
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228806 87565848 2 O10C14H27 A10B14C27 -824.78 3.56 -9.47 -0.12 0
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228807 87565850 1 ClO2S3N4H23C32 AB2C3D4E23F32 175.03 3.17 -8.69 -1.24 0
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228808 87565851 1 O2S3N5H7C8 A2B3C5D7E8 95.65 3.2 -9.04 -1.27 0
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228809 87565852 1 LiNC10H16 ABC10D16 27.9 7.56 -8.29 1.55 0
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228810 87565853 1 NOC6H13 ABC6D13 -49.4 3.88 -10.48 0.05 0
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228811 87565854 1 NSO5C7H15 ABC5D7E15 -195.1 5.23 -10.64 -0.08 0
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228812 87565856 1 N4O19C63H82 A4B19C63D82 -804.66 8.98 -9.62 -0.73 0
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228813 87565859 2 O3C6H13 A3B6C13 -323.35 3.69 -9.61 0.48 0
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228814 87565862 1 N3O3F5H26C27 A3B3C5D26E27 -275.71 4.04 -8.81 -1.31 0
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228815 87565863 1 O2N3F6H23C25 A2B3C6D23E25 -300.6 4.12 -8.89 -1.66 0
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228816 87565864 2 FN2O6C29H34 AB2C6D29E34 -526.79 7.3 -9.44 -0.45 0
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228817 87565865 2 FN2O6C29H34 AB2C6D29E34 -531.41 6.83 -9.38 -0.47 0
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228818 87565866 1 S2O3C6H12 A2B3C6D12 -138.28 2.26 -9.22 -0.49 1
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228819 87565867 1 N2O2C25H25 A2B2C25D25 36.22 5.05 0.0 0.0 0
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228820 87565872 1 O9C11H20 A9B11C20 -421.25 11.08 -10.65 0.03 0
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228821 87565874 1 SF3N3O7C22H30 AB3C3D7E22F30 -445.26 6.46 -9.3 -0.73 0
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228822 87565875 1 SN3O5C20H29 AB3C5D20E29 -203.46 1.46 -9.11 -0.52 0
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228823 87565880 1 O5C10H18 A5B10C18 -254.44 4.17 -10.66 0.2 0
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228824 87565884 1 NSO3F6H27C28 ABC3D6E27F28 -403.35 7.69 -8.68 -0.88 0
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228825 87565885 1 ClFO2S2N3C21H23 ABC2D2E3F21G23 -56.74 6.65 -9.18 -0.76 0
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228826 87565886 1 FO2S2N3C21H22 AB2C2D3E21F22 -21.09 3.92 -9.11 -0.56 0
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228827 87565890 1 ON2C8H20 AB2C8D20 -49.73 2.37 -8.53 2.03 0
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228828 87565894 1 O3N5F6C19H19 A3B5C6D19E19 -328.3 4.39 -9.5 -1.33 0
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228829 87565896 1 FNO2S2C23H24 ABC2D2E23F24 -47.7 2.16 -8.83 -0.4 0
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228830 87565898 1 N2O12C29H50 A2B12C29D50 -625.66 8.77 -10.15 -0.01 0
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228831 87565900 1 O9C10H20 A9B10C20 -405.35 6.26 -10.48 -0.14 0
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228832 87565901 1 NSO4C14H21 ABC4D14E21 -142.81 14.5 -9.23 -0.45 0
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228833 87565902 2 O5C7H13 A5B7C13 -480.95 6.99 -10.48 -0.53 0
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228834 87565904 1 O9C14H26 A9B14C26 -439.22 5.87 -10.65 -0.58 0
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228835 87565911 1 O7C18H38 A7B18C38 -361.33 4.8 -10.01 0.44 -4