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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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67101 46505876 1 O2C19H24 A2B19C24 -69.57 4.23 -8.87 0.03 0
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67102 46505877 2 FOH7C9 ABC7D9 -115.86 4.98 -9.33 -0.68 0
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67103 46505879 1 BrSO2H13C16 ABC2D13E16 -16.57 4.36 -9.3 -0.76 0
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67104 46505880 1 ON3C19H23 AB3C19D23 38.42 1.41 -8.69 -0.76 0
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67105 46505881 1 O3C29H36 A3B29C36 -88.08 5.71 -8.74 -0.32 0
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67106 46505883 1 OC29H36 AB29C36 -22.37 4.57 -9.19 -0.34 0
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67107 46505885 1 O5C33H44 A5B33C44 -174.99 4.52 -8.21 -0.36 0
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67108 46505889 1 OBr2F2H18C22 AB2C2D18E22 -66.44 2.02 -9.83 -0.94 0
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67109 46505891 1 O5C34H46 A5B34C46 -178.66 4.47 -8.29 -0.46 0
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67110 46505893 3 OC10H10 AB10C10 -41.4 3.4 -8.71 -0.42 0
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67111 46505895 1 OC30H30 AB30C30 28.21 3.58 -9.18 -0.4 0
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67112 46505896 1 O5C34H38 A5B34C38 -125.63 3.48 -8.26 -0.36 0
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67113 46505897 1 N2O3C33H42 A2B3C33D42 -71.13 2.9 -8.37 -0.39 0
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67114 46505899 1 N2O3C34H36 A2B3C34D36 -21.7 2.93 -8.38 -0.59 0
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67115 46505900 1 OF4H24C25 AB4C24D25 -176.74 2.0 -9.95 -0.87 0
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67116 46505904 1 N2O3C32H40 A2B3C32D40 -71.03 3.01 -8.35 -0.33 0
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67117 46505905 1 OBr2S2C21H22 AB2C2D21E22 21.25 2.5 -9.34 -1.25 0
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67118 46505907 1 OCl2F2H24C25 AB2C2D24E25 -104.2 4.73 -9.78 -0.75 0
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67119 46505909 1 OCl2F2H18C22 AB2C2D18E22 -91.37 4.63 -9.85 -0.61 0
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67120 46505910 1 OCl2F2H18C26 AB2C2D18E26 -53.02 4.32 -9.35 -0.63 0
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67121 46505911 1 O3C26H30 A3B26C30 -71.9 2.02 -8.67 -0.22 0
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67122 46505914 1 O3N5C32H35 A3B5C32D35 39.1 9.52 -8.93 -0.64 0
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67123 46505916 1 NO5C33H45 AB5C33D45 -159.24 1.79 -8.2 -0.44 0
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67124 46505917 1 O5C37H52 A5B37C52 -187.64 4.11 -8.16 -0.56 0
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67125 46505918 1 O3C35H48 A3B35C48 -116.94 6.3 -8.46 -0.21 0
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67126 46505919 1 O5C36H50 A5B36C50 -183.89 5.04 -8.04 -0.36 0
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67127 46505921 1 O5C34H46 A5B34C46 -178.05 2.58 -8.13 -0.27 0
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67128 46505923 1 O5C38H46 A5B38C46 -142.63 2.77 -8.23 -0.25 0
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67129 46505924 3 OC12H14 AB12C14 -66.62 2.87 -8.5 -0.26 0
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67130 46505925 1 NO3H17C18 AB3C17D18 -19.28 3.39 -8.9 -1.0 0
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67131 46505927 1 NO5C26H29 AB5C26D29 -103.69 3.02 -8.17 -0.3 0
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67132 46505928 1 NO5C26H29 AB5C26D29 -116.76 3.17 -8.17 -0.32 0
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67133 46505929 1 NO5C26H29 AB5C26D29 -107.72 3.83 -8.06 -0.18 0
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67134 46505932 1 N3O5H19C22 A3B5C19D22 33.9 2.66 -9.66 -1.56 0
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67135 46505933 1 NOC24H25 ABC24D25 26.08 1.42 -9.0 -0.48 0
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67136 46505934 1 NO7C28H33 AB7C28D33 -182.31 6.93 -8.62 -0.63 0
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67137 46505935 1 NOC24H25 ABC24D25 24.09 1.62 -8.95 -0.55 0
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67138 46505937 1 NO7C28H33 AB7C28D33 -185.18 2.28 -7.98 -0.31 0
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67139 46505938 1 NO5C26H29 AB5C26D29 -107.56 5.44 -8.31 -0.44 0
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67140 46505940 1 NBr2O3H23C24 AB2C3D23E24 -30.53 3.48 -8.98 -0.5 0
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67141 46505943 1 NOF6H19C24 ABC6D19E24 -283.37 2.14 -9.58 -0.98 0
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67142 46505944 1 NBr2O3H23C24 AB2C3D23E24 -29.64 6.17 -9.01 -0.57 0
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67143 46505947 1 NO5C34H45 AB5C34D45 -155.11 4.38 -8.37 -0.5 0
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67144 46505948 1 NO5C30H37 AB5C30D37 -139.44 4.06 -8.28 -0.56 0
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67145 46505949 1 N3O3C30H35 A3B3C30D35 -38.51 1.19 -8.37 -0.54 0
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67146 46505951 1 NO5C34H45 AB5C34D45 -158.97 5.0 -8.35 -0.54 0
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67147 46505952 1 NO3C30H37 AB3C30D37 -71.68 4.03 -8.75 -0.53 0
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67148 46505954 1 NOBr2H19C22 ABC2D19E22 46.72 3.71 -9.38 -0.75 0
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67149 46505958 1 O3C20H26 A3B20C26 -98.14 2.57 -8.27 -0.37 0
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67150 46505959 1 NOCl2H19C22 ABC2D19E22 23.87 2.36 -8.99 -0.64 0