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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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387046 134983782 1 NO4H27C29 AB4C27D29 -0.17 5.97 -8.85 -0.43 0
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387047 134983783 1 NO2C18H25 AB2C18D25 -6.19 4.13 -9.67 -0.37 0
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387048 134983784 1 NOC6F13 ABC6D13 -633.39 0.98 -11.3 -2.58 0
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387049 134983788 1 NO3H9C11 AB3C9D11 32.14 2.55 -10.02 -1.27 0
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387050 134983790 1 N2O7C21H22 A2B7C21D22 -167.32 3.41 -9.71 -1.17 0
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387051 134983791 1 SN2O4C23H26 AB2C4D23E26 -51.68 3.24 -8.94 -0.58 0
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387052 134983792 1 SN2O5C17H22 AB2C5D17E22 -98.06 6.11 -9.6 -0.58 0
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387053 134983795 1 N2O5C21H30 A2B5C21D30 -135.5 2.86 -9.37 -0.39 0
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387054 134983797 1 NSiO7C20H33 ABC7D20E33 -251.48 6.37 -9.12 -0.8 0
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387055 134983798 1 NO4C13H17 AB4C13D17 -89.17 5.16 -9.85 -0.74 0
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387056 134983799 1 N2O3C8H16 A2B3C8D16 -76.23 7.65 -10.0 -0.39 0
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387057 134983803 1 SN2O3C15H26 AB2C3D15E26 -97.54 14.15 -9.48 -0.96 0
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387058 134983806 4 OSN2C5H10 ABC2D5E10 -87.4 3.69 -7.69 -0.7 0
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387059 134983807 1 NBr2O4C11H11 AB2C4D11E11 -90.86 4.63 -9.81 -1.04 0
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387060 134983817 1 NOSeC21H27 ABCD21E27 19.34 2.16 -8.45 -0.3 0
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387061 134983819 1 NSiO4C21H31 ABC4D21E31 -169.99 2.94 -8.94 -0.03 0
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387062 134983825 1 PC25H29 AB25C29 11.8 1.73 -8.52 0.4 0
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387063 134983826 1 PC26H31 AB26C31 6.91 1.98 -8.51 0.42 0
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387064 134983827 1 PWSi2O5C12H20 ABC2D5E12F20 -226.66 5.03 0.0 0.0 0
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387065 134983829 1 PWO5C15H17 ABC5D15E17 -155.74 5.68 -6.92 0.64 0
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387066 134983833 1 FeNPC12H15 ABCD12E15 35.18 1.95 0.0 0.0 0
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387067 134983835 1 FeNPC13H17 ABCD13E17 69.33 2.63 0.0 0.0 0
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387070 134983842 1 N3C6H11 A3B6C11 65.65 3.46 -9.76 0.09 0
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387071 134983843 1 O4N5C16H19 A4B5C16D19 -36.22 6.1 -9.51 -1.92 0
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387072 134983851 1 Br4N4O5H10C15 A4B4C5D10E15 14.76 5.88 -10.49 -1.94 1
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387073 134983856 1 SF3N3O3C8H11 AB3C3D3E8F11 -206.81 2.83 0.0 0.0 0
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387074 134983857 1 SO3H22C27 AB3C22D27 -15.16 4.96 -8.88 -0.66 0
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387076 134983884 1 NOPC22H32 ABCD22E32 -78.25 3.88 -9.32 -0.1 0
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387077 134983891 1 NSO3C22H27 ABC3D22E27 -96.82 6.27 -9.4 -0.57 0
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387078 134983901 1 NO2C21H27 AB2C21D27 -51.17 3.29 -9.1 -0.66 0
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387079 134983907 1 BrClNOSC31H37 ABCDEF31G37 15.64 3.04 -8.56 -0.41 0
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387080 134983910 1 NO15C25H37 AB15C25D37 -646.82 6.91 -10.94 -0.52 0
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387081 134983916 2 NO2C9H12 AB2C9D12 -77.14 6.27 -9.28 -0.4 0
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387082 134983934 2 NO2C8H16 AB2C8D16 -203.49 0.3 -8.28 0.76 0
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387084 134983936 1 NPWO5C10H11 ABCD5E10F11 -64.12 1.27 0.0 0.0 -2
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387085 134983938 1 PTaN4Si4C18H48 ABC4D4E18F48 -306.67 14.62 -7.03 -0.26 1
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387086 134983941 1 PSiTaC8H11 ABCD8E11 -147.17 3.95 0.0 0.0 0
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387087 134983942 1 RhP2C37H42 AB2C37D42 40.34 25.83 0.0 0.0 0
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387088 134983945 1 MoNPC18H31 ABCD18E31 85.14 5.58 0.0 0.0 0
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387089 134983947 1 N4O10H40C45 A4B10C40D45 -238.0 7.85 -9.21 -0.82 0
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387090 134983948 2 N2O3C6H7 A2B3C6D7 -109.62 6.02 -9.72 -1.7 0
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387091 134983950 1 Cl3N6H17C22 A3B6C17D22 134.95 5.09 -8.76 -1.38 0
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387092 134983953 1 O5N6C12H12 A5B6C12D12 39.34 6.54 -10.25 -2.32 0
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387093 134983954 1 N5H19C21 A5B19C21 171.17 5.53 -9.18 -1.47 0
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387094 134983956 1 BrN4O4C11H13 AB4C4D11E13 -28.47 5.68 -9.74 -1.76 0
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387095 134983966 1 ON4C28H32 AB4C28D32 117.44 4.81 -8.8 0.0 0
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387096 134983967 2 NO2C9H18 AB2C9D18 -167.61 1.89 -9.67 0.19 0
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387097 134983973 2 NC5H6 AB5C6 80.33 0.16 -9.1 0.26 0
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387098 134983980 1 ClNOC16H24 ABCD16E24 -32.12 7.24 -9.25 0.04 0
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387099 134983982 2 H2N2C3O3 A2B2C3D3 21.8 3.38 -10.75 -2.52 0
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387100 134983987 1 PSN2O3C14H15 ABC2D3E14F15 -53.77 6.67 -8.99 -1.33 0
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387101 134983988 1 BrSN3O5C18H20 ABC3D5E18F20 -128.66 9.15 -9.15 -0.87 0
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387102 134984001 1 N2O6C23H24 A2B6C23D24 -163.82 3.62 -9.17 -0.32 0
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387103 134984005 2 NO2C7H8 AB2C7D8 -55.6 3.82 -10.06 -0.63 0
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387104 134984007 2 NOC6H12 ABC6D12 -41.57 4.14 -9.12 -0.34 0
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387105 134984016 1 NO10C15H23 AB10C15D23 -397.68 3.94 -11.04 -0.62 0
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387106 134984021 1 NO3C15H21 AB3C15D21 -45.27 5.18 -9.91 -0.45 0
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387107 134984029 2 NOC3H7 ABC3D7 -73.78 6.55 -9.46 0.47 0
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387108 134984032 1 N2O3C15H24 A2B3C15D24 -101.84 1.39 -8.26 0.24 0
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387109 134984036 1 NOC17H19 ABC17D19 40.72 1.08 -9.21 0.31 0
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387110 134984038 1 ClN3O4C25H26 AB3C4D25E26 -28.71 7.52 -9.61 -1.6 0
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387111 134984048 1 ON3C11H15 AB3C11D15 16.5 2.41 -8.64 -0.4 0
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387112 134984049 4 NOC3H3 ABC3D3 -63.32 3.7 -9.57 -1.46 0
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387113 134984054 1 ClSO2N4C12H15 ABC2D4E12F15 -4.51 4.66 -9.84 -1.12 0
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387114 134984058 1 O3N5C9H13 A3B5C9D13 -5.41 6.4 -9.81 -1.88 0
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387115 134984059 2 OC4N4H6 AB4C4D6 67.66 6.89 -9.89 -2.64 0
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387116 134984066 1 O2N3C11H13 A2B3C11D13 46.37 4.06 -10.26 -1.2 0
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387117 134984071 2 PF3C12H13 AB3C12D13 -437.63 17.46 -9.71 -1.03 0
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387118 134984074 1 PBr2C16H19 AB2C16D19 5.6 5.45 -8.95 -0.74 0
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387119 134984080 1 SN2O3C19H26 AB2C3D19E26 -71.69 5.85 -9.03 -0.5 0
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387120 134984089 1 NSiO3C28H41 ABC3D28E41 -150.88 1.2 -9.2 0.51 0
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387121 134984091 1 NO2C19H27 AB2C19D27 -42.67 3.64 -8.39 0.2 0
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387122 134984092 1 S2N5O6C23H29 A2B5C6D23E29 -85.41 4.3 -9.45 -1.96 0
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387123 134984093 1 NCl2H17C18 AB2C17D18 64.5 2.86 -8.96 -0.28 0
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387124 134984094 1 ClNC18H18 ABC18D18 74.84 1.46 -8.7 -0.33 0