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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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295100 117517318 1 BrFO4C14H16 ABC4D14E16 -194.57 4.46 -9.41 -0.88 0
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295101 117517358 1 BrO5C14H19 AB5C14D19 -201.49 4.68 -8.65 -0.28 0
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295102 117517362 1 BrO5C14H19 AB5C14D19 -192.32 3.66 -9.06 -0.43 0
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295103 117517384 1 BrFN2O2C14H20 ABC2D2E14F20 -95.17 3.1 -8.52 -0.21 0
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295104 117517476 1 BrN3O3H10C14 AB3C3D10E14 -0.64 0.87 -9.41 -1.86 0
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295105 117517537 1 BrNOC18H22 ABCD18E22 -18.35 4.52 -8.72 -0.65 0
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295106 117517540 1 SN2O4C17H20 AB2C4D17E20 -103.68 6.63 -8.88 -0.79 0
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295107 117517553 1 BrClN3O3C11H11 ABC3D3E11F11 -18.49 3.09 -9.24 -0.92 0
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295108 117517567 1 ClS2O4C14H17 AB2C4D14E17 -158.87 6.6 -8.72 -1.11 0
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295109 117517574 1 BrFO5C13H14 ABC5D13E14 -230.46 5.31 -9.28 -0.84 0
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295110 117517596 1 BrSO5C12H13 ABC5D12E13 -161.71 5.69 -10.32 -1.44 0
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295111 117517630 1 BrON2C17H21 ABC2D17E21 -22.62 5.17 -8.78 -0.3 0
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295112 117517652 1 FNS2O4C14H20 ABC2D4E14F20 -197.76 10.52 -9.02 -1.11 0
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295113 117517656 1 BrClSO3H10C12 ABCD3E10F12 -86.27 5.4 -9.01 -1.26 0
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295114 117517687 1 BrNO3C16H16 ABC3D16E16 -76.02 4.69 -9.62 -0.75 0
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295115 117517798 1 BrN2O4H11C14 AB2C4D11E14 -68.99 8.15 -9.17 -0.96 0
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295116 117517813 1 BrN2O3C15H15 AB2C3D15E15 -59.18 6.93 -8.65 -1.83 0
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295117 117517921 1 BrNO4H14C15 ABC4D14E15 -104.33 4.12 -9.35 -1.11 0
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295118 117517957 1 BrNOF3C14H17 ABCD3E14F17 -178.7 2.23 -9.23 -0.89 0
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295119 117517959 1 BrNOF3C14H17 ABCD3E14F17 -188.77 2.26 -9.26 -0.76 0
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295120 117517991 1 BrNO3C16H18 ABC3D16E18 -51.58 4.7 -8.73 -0.4 0
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295121 117517992 1 BrNO3C16H18 ABC3D16E18 -52.12 3.89 -8.74 -0.4 0
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295122 117517994 1 BrNO3C16H18 ABC3D16E18 -74.06 7.21 -8.64 -0.28 0
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295123 117517995 1 BrNO3C16H18 ABC3D16E18 -89.0 6.13 -8.83 -0.36 0
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295124 117518100 1 BrSN3C15H18 ABC3D15E18 54.58 3.82 -8.52 -0.23 0
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295125 117518168 1 ClO4C19H25 AB4C19D25 -180.7 4.25 -8.76 -0.39 0
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295126 117518208 1 BrN2O4H13C14 AB2C4D13E14 -97.08 8.54 -9.2 -0.88 0
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295127 117518241 1 BrON2F3C13H16 ABC2D3E13F16 -169.67 3.74 -8.95 -0.94 0
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295128 117518245 1 BrS2O5H9C10 AB2C5D9E10 -151.67 4.04 -9.07 -2.22 0
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295129 117518249 1 BrO4C16H17 AB4C16D17 -134.11 4.89 -8.67 -0.59 0
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295130 117518253 1 BrO4C16H17 AB4C16D17 -112.35 3.72 -9.24 -0.62 0
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295131 117518259 1 BrO4C16H17 AB4C16D17 -135.98 6.78 -9.23 -0.73 0
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295132 117518271 1 BrN2O3C15H17 AB2C3D15E17 -56.32 4.4 -8.61 -1.83 0
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295133 117518274 1 BrN2O3C15H17 AB2C3D15E17 -71.0 7.84 -9.64 -0.86 0
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295134 117518284 1 BrN2O3C15H17 AB2C3D15E17 -42.11 5.05 -9.02 -0.31 0
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295135 117518285 1 BrN2O3C15H17 AB2C3D15E17 -52.64 5.46 -8.57 -0.55 0
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295136 117518295 1 BrN2O3C15H17 AB2C3D15E17 -47.91 3.75 -8.34 -0.34 0
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295137 117518311 1 BrO3C17H21 AB3C17D21 -105.45 2.61 -9.25 -0.57 0
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295138 117518313 1 BrO3C17H21 AB3C17D21 -108.06 6.0 -9.31 -0.63 0
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295139 117518316 1 BrO3C17H21 AB3C17D21 -100.4 5.36 -9.74 -0.62 0
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295140 117518355 1 BrN2O2C16H21 AB2C2D16E21 -40.89 1.4 -8.45 -0.13 0
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295141 117518434 1 BrNO5H12C14 ABC5D12E14 -112.62 8.39 -9.37 -1.35 0
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295142 117518457 1 BrNO4C15H16 ABC4D15E16 -91.24 2.77 -9.15 -1.46 0
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295143 117518537 1 BrO2N3C15H20 AB2C3D15E20 -18.89 3.66 -9.01 -0.16 0
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295144 117518538 1 BrO2N3C15H20 AB2C3D15E20 -21.1 3.11 -8.53 -0.29 0
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295145 117518599 1 BrNO2C17H24 ABC2D17E24 -79.44 5.2 -8.19 -0.1 0
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295146 117518609 1 BrNO2C17H24 ABC2D17E24 -70.87 2.95 -8.35 0.0 0
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295147 117518621 1 BrNO2C17H24 ABC2D17E24 -76.0 6.09 -8.39 -0.1 0
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295148 117518691 1 BrNSC17H24 ABCD17E24 -4.91 2.78 -8.55 -0.16 0
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295149 117518711 1 BrF3O4H10C12 AB3C4D10E12 -289.35 4.04 -9.82 -1.44 0