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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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177102 76135368 2 O6C8H15 A6B8C15 -565.19 3.07 -10.24 0.39 0
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177103 76135369 1 S4O5N8C19H20 A4B5C8D19E20 -17.66 7.59 -8.98 -1.14 0
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177104 76135370 1 ClFN2O4C21H22 ABC2D4E21F22 -159.57 1.13 -9.04 -0.4 0
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177105 76135375 2 OSC12H17 ABC12D17 -88.69 4.14 -8.61 0.05 0
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177106 76135376 2 O4C24H39 A4B24C39 -476.77 7.81 -10.32 0.61 0
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177107 76135377 1 ClSN2O3C30H35 ABC2D3E30F35 -82.31 6.05 -9.18 -0.74 0
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177108 76135486 1 Br2O2N5C21H21 A2B2C5D21E21 32.85 8.8 -9.16 -0.74 1
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177109 76135596 1 ON4C9H13 AB4C9D13 17.21 9.27 0.0 0.0 0
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177110 76135597 1 FO3C22H39 AB3C22D39 -235.6 3.59 -9.9 0.77 0
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177111 76136184 1 NO6C15H31 AB6C15D31 -317.12 2.42 -9.37 1.12 0
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177112 76136224 1 S2N6O7C15H16 A2B6C7D15E16 -167.59 3.22 -9.18 -1.0 0
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177113 76136306 1 N2S2O7C14H24 A2B2C7D14E24 -329.52 2.66 -9.5 -0.43 0
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177114 76136469 1 ClN2O7C36H43 AB2C7D36E43 -255.3 5.74 -8.8 -0.29 0
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177115 76136470 1 IN3O9C22H32 AB3C9D22E32 -372.03 3.92 -9.6 -1.53 0
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177116 76137047 1 O7C22H38 A7B22C38 -342.01 3.23 -10.5 -1.34 0
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177117 76137048 2 N3O3C10H14 A3B3C10D14 -215.07 10.01 -9.3 -0.46 0
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177118 76137049 1 N2O8C45H50 A2B8C45D50 -274.91 6.99 -9.13 -1.43 0
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177119 76137050 1 SO10C12H22 AB10C12D22 -455.76 0.58 -9.39 -0.06 0
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177120 76137051 1 ON2H8C10 AB2C8D10 59.83 7.82 -9.42 -2.31 0
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177121 76137052 1 N2O3C14H14 A2B3C14D14 -41.62 3.91 -9.17 -1.09 0
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177123 76137054 1 N5C9H15 A5B9C15 81.79 11.5 -8.73 -0.52 0
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177124 76137055 1 SN3O5C21H31 AB3C5D21E31 -206.25 2.02 -8.71 -1.19 0
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177125 76137056 1 O5C22H28 A5B22C28 -235.18 2.31 -9.16 -0.04 0
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177126 76137057 1 N2O4C9H18 A2B4C9D18 -203.41 5.26 -9.71 0.17 0
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177127 76137058 1 S4N6O7C34H40 A4B6C7D34E40 -201.89 15.21 -8.61 -1.28 0
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177128 76137059 1 N3S3O4C20H27 A3B3C4D20E27 -136.93 8.76 -8.63 -0.75 0
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177129 76137060 1 SN2O5C25H32 AB2C5D25E32 -192.23 10.92 -9.51 -0.92 0
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177130 76137478 1 N4O5H48C55 A4B5C48D55 30.01 7.98 -9.04 -0.36 0
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177131 76138415 1 S3O7C21H28 A3B7C21D28 -285.74 8.56 -9.37 -0.56 0
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177132 76139079 1 S2N5O5H11C12 A2B5C5D11E12 -48.8 4.08 -9.76 -1.42 0
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177133 76139089 2 O3C13H17 A3B13C17 -248.05 4.04 -9.19 -0.69 0
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177134 76139265 1 S2N3O6C31H45 A2B3C6D31E45 -212.13 4.89 -8.28 -0.66 -1
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177135 76139596 1 SSi4O10C29H41 AB4C10D29E41 -551.18 5.44 0.0 0.0 0
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177136 76139597 1 SN2O5C17H18 AB2C5D17E18 -166.17 6.51 -9.04 -0.7 0
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177137 76139920 1 SN2O4C12H16 AB2C4D12E16 -147.9 3.64 -9.46 -0.63 0
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177138 76140854 1 ON4C11H26 AB4C11D26 -67.13 2.0 -8.89 1.24 0
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177139 76140855 1 PS2N7O8C20H24 AB2C7D8E20F24 -258.31 6.87 -9.3 -1.15 0
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177140 76140856 1 N12S13O14C131H206 A12B13C14D131E206 -608.62 4.92 -8.21 -1.35 0
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177141 76141141 1 SN7O7C28H31 AB7C7D28E31 -30.47 6.62 -8.73 -1.45 0
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177142 76141242 1 NCl2O5H19C21 AB2C5D19E21 -176.67 4.98 -9.3 -1.08 0
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177143 76141243 1 O9C59H106 A9B59C106 -563.0 2.69 -9.44 0.61 0
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177144 76141244 1 F2N2O7C18H18 A2B2C7D18E18 -366.82 8.27 -10.35 -0.92 0
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177145 76141282 1 N3O8C37H45 A3B8C37D45 -296.03 3.58 -8.87 -1.33 0
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177146 76141419 1 S2N4O7C22H22 A2B4C7D22E22 -168.87 8.36 -9.37 -0.99 0
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177147 76141420 1 SO5C24H36 AB5C24D36 -252.17 5.2 -8.58 -0.09 0
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177148 76141421 1 SN3O10C45H83 AB3C10D45E83 -598.53 6.33 -9.16 -0.34 0
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177149 76141422 1 N2S2O3C16H20 A2B2C3D16E20 -116.03 3.79 -9.14 -0.43 1
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177150 76141757 1 O3N4C25H33 A3B4C25D33 -59.04 3.28 0.0 0.0 0
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177151 76141806 1 FN2O7C33H37 AB2C7D33E37 -274.46 8.82 -8.79 -0.17 0
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177152 76141807 1 O6C33H34 A6B33C34 -181.47 3.94 -8.66 -0.25 0