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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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313069 126611578 1 NO6C9H19 AB6C9D19 -299.61 2.46 -10.19 0.76 0
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313070 126611591 1 NO5H13C17 AB5C13D17 -55.34 7.79 -9.95 -1.68 0
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313071 126611626 1 ClFON3H15C17 ABCD3E15F17 7.87 7.04 -9.67 -0.7 0
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313073 126611652 1 NSF3O5C8H12 ABC3D5E8F12 -372.4 4.53 -10.34 -0.32 0
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313074 126611662 1 SO2N3C24H25 AB2C3D24E25 1.69 6.97 -8.07 -0.33 0
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313075 126611686 1 NO2C29H37 AB2C29D37 -57.86 3.67 -8.52 0.13 0
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313076 126611695 1 SO2N5C15H17 AB2C5D15E17 35.31 2.75 -8.17 -0.79 0
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313077 126611697 1 IOC4H9 ABC4D9 -53.0 3.99 -9.63 -0.94 0
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313078 126611698 1 SO2N4C9H14 AB2C4D9E14 -8.95 4.76 -8.42 -0.17 0
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313079 126611708 1 N2O3F9C27H33 A2B3C9D27E33 -537.48 1.84 -9.11 -1.23 0
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313080 126611709 1 PN5O5F9C46H71 AB5C5D9E46F71 -738.0 6.1 -8.46 -0.55 0
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313081 126611739 1 INSO2H6C10 ABCD2E6F10 -17.13 1.85 -9.02 -2.66 0
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313082 126611744 1 BrO2C13H19 AB2C13D19 -88.19 2.03 -9.48 -0.23 0
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313083 126611745 1 ClSO2N4C8H13 ABC2D4E8F13 -41.75 3.29 -8.54 -0.32 0
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313084 126611767 1 SO2N4C13H16 AB2C4D13E16 -2.9 2.55 -9.11 -0.84 0
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313085 126611774 1 FNO2H6C8 ABC2D6E8 -89.45 2.8 -9.19 -1.14 0
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313086 126611779 1 SN2O2H14C16 AB2C2D14E16 -4.84 3.89 -8.66 -1.3 0
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313087 126611796 1 SN3O4H9C11 AB3C4D9E11 -24.43 7.2 -9.97 -1.94 0
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313088 126611808 1 SF2O2N4C26H36 AB2C2D4E26F36 -107.84 1.86 -6.72 -0.67 0
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313089 126611809 1 SF2O2N4C25H34 AB2C2D4E25F34 -101.53 2.69 -6.87 -0.64 -1
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313090 126611829 1 SN4O4C20H23 AB4C4D20E23 -43.44 9.0 0.0 0.0 0
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313091 126611830 1 SN4O4C20H24 AB4C4D20E24 -87.96 8.17 -8.34 -0.25 0
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313092 126611837 1 SF2O3N4C24H24 AB2C3D4E24F24 -149.57 7.59 -8.6 -0.78 0
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313093 126611851 1 NO5C13H15 AB5C13D15 -157.48 3.18 -9.93 -0.61 0
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313094 126611853 2 NO4C13H19 AB4C13D19 -326.01 3.3 -8.72 -0.43 0
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313095 126611863 1 BrF3N3O3H13C18 AB3C3D3E13F18 -177.62 4.01 -9.75 -1.58 0
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313096 126611868 1 O11N21C45H91 A11B21C45D91 -464.42 10.71 -8.86 -0.61 0
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313097 126611870 1 ON2C9H16 AB2C9D16 -2.01 2.36 -8.28 0.58 0
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313098 126611896 1 ClON5H24C25 ABC5D24E25 54.88 5.04 -9.02 -0.88 0
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313099 126611899 1 ClON4C27H27 ABC4D27E27 33.55 6.4 -9.2 -0.87 0
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313100 126611970 1 ClF2O3N4H25C29 AB2C3D4E25F29 -133.27 6.34 -9.0 -1.35 0
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313101 126611974 1 ClNO2C19H28 ABC2D19E28 -117.51 3.64 -9.5 -0.06 0
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313102 126611976 1 SO2F3H29C33 AB2C3D29E33 -163.58 1.43 -9.1 -1.15 0
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313103 126611978 1 ClF2N2O4H33C34 AB2C2D4E33F34 -219.32 4.69 -9.04 -1.26 0
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313104 126611983 1 NO2C11H17 AB2C11D17 -33.15 3.25 -9.36 0.09 0
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313105 126611985 1 SC19H34 AB19C34 -47.78 0.97 -8.94 0.08 0
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313106 126611987 1 NO4C18H21 AB4C18D21 -61.54 6.57 -8.81 -0.69 0
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313107 126611988 2 N2C14H15 A2B14C15 146.24 2.08 -7.78 -0.68 0
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313108 126612017 1 NF3C10H14 AB3C10D14 -139.65 3.36 -9.36 -0.02 0
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313109 126612041 1 F3O3N5C22H24 A3B3C5D22E24 -186.48 2.57 -9.14 -0.82 0
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313110 126612054 1 NOH41C50 ABC41D50 101.43 1.27 -7.77 -0.8 0
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313111 126612060 1 NOH49C68 ABC49D68 206.58 2.99 -7.72 -0.79 0
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313112 126612065 1 NO3H29C46 AB3C29D46 116.65 2.63 -7.93 -0.92 0
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313113 126612067 1 NOH37C54 ABC37D54 193.07 2.27 -7.77 -0.4 0
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313114 126612068 1 NOC124H129 ABC124D129 129.49 3.26 -7.67 -0.71 0
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313115 126612069 1 NO3H33C52 AB3C33D52 139.65 2.18 -7.94 -0.91 0
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313116 126612070 1 NOH61C92 ABC61D92 436.83 5.54 -8.35 -1.41 0
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313117 126612071 1 NOH49C60 ABC49D60 119.94 1.82 -7.47 -0.71 0
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313118 126612074 1 NOH61C92 ABC61D92 318.66 1.0 -7.59 -0.72 0
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313119 126612076 1 NO3H29C48 AB3C29D48 119.88 3.41 -7.81 -0.73 0