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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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182104 76842522 1 N2O9H22C27 A2B9C22D27 -284.14 8.3 -8.83 -1.88 0
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182105 76842962 1 N5O6C30H49 A5B6C30D49 -241.05 1.81 -9.04 0.14 0
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182106 76842963 1 N5O7C27H43 A5B7C27D43 -182.14 4.32 -9.18 -1.84 0
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182107 76843111 1 N2F3O3C22H29 A2B3C3D22E29 -322.61 2.79 -9.65 -0.74 0
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182108 76843584 1 OSN2C17H18 ABC2D17E18 -3.58 5.23 -8.44 -0.28 -2
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182109 76843585 1 NYC9H9 ABC9D9 107.51 3.47 0.0 0.0 -2
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182111 76845350 1 NO2H13C16 AB2C13D16 13.26 8.85 -9.25 -1.08 0
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182112 76845895 1 S2N3O3C16H17 A2B3C3D16E17 -69.07 3.24 -8.74 -1.1 0
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182113 76846330 1 ClON2H5C8 ABC2D5E8 25.11 3.32 -9.61 -1.45 0
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182114 76846583 1 NO2C15H15 AB2C15D15 -13.74 3.88 -8.84 -0.38 0
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182115 76846699 1 ON3C23H31 AB3C23D31 -26.08 6.45 -8.19 -0.06 0
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182116 76846951 1 INSO4H8C9 ABCD4E8F9 -114.13 8.44 -9.2 -0.94 0
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182117 76846975 1 NOC20H23 ABC20D23 -19.11 5.41 -9.25 -0.32 0
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182118 76847757 1 O2N4H8C11 A2B4C8D11 21.6 5.22 -8.96 -0.81 0
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182119 76847955 1 O2H10C11 A2B10C11 -35.48 2.31 -9.35 -0.68 0
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182120 76848056 1 ClO2N3H6C8 AB2C3D6E8 -20.71 4.48 -9.74 -1.46 0
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182121 76848346 1 ON2H8C11 AB2C8D11 52.2 7.91 -9.63 -1.94 0
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182122 76848508 1 BrN3C10H10 AB3C10D10 78.49 3.51 -9.03 -0.93 0
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182123 76848564 1 BrNO2C12H18 ABC2D12E18 -72.8 3.3 -8.72 -0.32 0
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182124 76849239 1 N2O2C11H14 A2B2C11D14 -66.91 1.1 -8.24 0.2 0
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182125 76849643 1 ClON2H7C8 ABC2D7E8 -0.33 2.67 -9.16 -0.93 -1
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182127 76850772 1 NO2C10H11 AB2C10D11 -51.36 4.4 -9.29 -0.32 0
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182128 76850773 1 NO4H21C23 AB4C21D23 -80.66 3.46 -8.86 -0.93 0
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182129 76850774 1 NO3C17H17 AB3C17D17 -57.79 4.68 -8.77 -0.56 0
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182130 76851180 1 ClON2C7H9 ABC2D7E9 -38.62 1.66 -8.24 -0.11 0
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182131 76851235 1 ClFSN2O4H24C26 ABCD2E4F24G26 -130.97 5.94 -8.56 -1.27 0
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182132 76851270 1 FON2H5C8 ABC2D5E8 6.2 5.88 -9.92 -1.81 0
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182133 76852023 1 F3O3N4H11C14 A3B3C4D11E14 -209.47 1.91 -10.4 -2.18 0
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182134 76852189 1 ClNO4C11H16 ABC4D11E16 -175.91 6.87 -9.13 -0.35 0
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182135 76852190 1 ClO2C9H11 AB2C9D11 -78.25 1.98 -8.76 -0.06 0
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182136 76852191 1 I2O3C8H8 A2B3C8D8 -89.24 4.85 -9.64 -1.53 0
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182137 76852192 1 ClOF2H3C6 ABC2D3E6 -119.68 1.87 -9.43 -0.85 0
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182138 76852208 1 FN4H17C20 AB4C17D20 59.3 2.41 -8.75 -0.44 0
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182139 76852209 1 FON4C15H15 ABC4D15E15 -2.61 2.12 -8.73 -0.59 0
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182140 76852210 1 F3N4C18H19 A3B4C18D19 -90.04 5.8 -8.92 -0.92 0
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182141 76852243 1 N5O6C20H21 A5B6C20D21 -177.32 7.57 -9.51 -0.98 0
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182142 76852616 1 ClN2O2C21H21 AB2C2D21E21 -32.78 3.82 -8.62 -0.77 0
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182143 76852675 1 ClON3C16H24 ABC3D16E24 -51.33 3.49 -8.71 -0.19 0
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182144 76853131 1 N3O3H21C26 A3B3C21D26 13.74 3.28 -9.1 -1.08 0
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182145 76853132 1 N2O5H24C28 A2B5C24D28 -65.91 4.7 -8.34 -1.06 0
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182146 76853174 1 ClN2O5C21H25 AB2C5D21E25 -186.15 6.25 -8.79 -0.67 0
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182147 76853338 5 OC4H4 AB4C4 -138.59 3.75 -8.54 -0.8 0
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182148 76853406 1 O4C21H32 A4B21C32 -208.24 2.54 -9.27 0.17 0
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182149 76853519 1 SO5N7C51H61 AB5C7D51E61 -121.91 11.19 -9.13 -0.38 0
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182151 76853632 1 NO6H37C42 AB6C37D42 -127.89 8.28 -8.98 -1.1 0
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182152 76853791 1 N2Cl3C15H17 A2B3C15D17 -25.78 2.79 -8.76 -0.25 0
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182153 76853814 1 N2Cl3C15H17 A2B3C15D17 -27.32 3.42 -8.58 -0.28 0
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182154 76853815 1 N3Cl4C14H15 A3B4C14D15 -38.26 2.88 -8.3 -0.89 0
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182155 76853816 1 N3Cl4C14H15 A3B4C14D15 -27.16 4.05 -8.31 -0.69 0
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182156 76853831 1 BrCl2N2C11H15 AB2C2D11E15 -22.87 1.18 -8.67 -0.24 0