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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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232135 87575586 1 SN3O6C21H21 AB3C6D21E21 -195.49 7.18 -9.22 -1.41 0
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232136 87575587 1 NS4O27C57H83 AB4C27D57E83 -1259.25 6.69 -8.88 -0.02 0
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232137 87575589 1 OTeC12H14 ABC12D14 -17.85 3.28 -8.04 -0.26 0
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232138 87575590 1 O3C11H16 A3B11C16 -100.45 2.94 -10.25 0.71 0
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232139 87575591 1 BrN2O4H17C20 AB2C4D17E20 -120.28 11.82 -9.16 -1.61 0
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232140 87575592 1 F2N4O5H22C27 A2B4C5D22E27 -217.67 7.08 -8.98 -1.74 0
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232141 87575593 1 FO3N4C26H31 AB3C4D26E31 -140.0 8.69 -8.5 -1.38 0
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232142 87575594 1 ClON6C15H21 ABC6D15E21 6.56 6.58 -8.72 -0.09 0
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232143 87575596 1 OSeC12H14 ABC12D14 -23.47 2.82 -8.29 -0.08 0
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232144 87575597 1 SN5O5C29H35 AB5C5D29E35 -157.28 6.46 -8.82 -1.53 0
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232145 87575598 1 ON3C33H45 AB3C33D45 -18.22 1.4 -8.65 0.02 0
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232146 87575599 1 ClO3N6C21H27 AB3C6D21E27 -73.98 5.11 -8.77 -0.28 0
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232147 87575600 1 N3H7C12 A3B7C12 121.76 5.68 -9.08 -1.6 0
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232148 87575601 1 ClSbH11C18 ABC11D18 117.13 1.38 0.0 0.0 0
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232149 87575604 1 NO2C11H11 AB2C11D11 -44.3 1.12 -10.02 -0.72 0
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232150 87575605 1 NSO2C4H7 ABC2D4E7 -70.3 4.67 -10.04 -0.84 0
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232151 87575607 1 ClO2N6C20H25 AB2C6D20E25 -31.75 3.17 -8.97 -0.3 0
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232152 87575608 1 ClO2N6C20H25 AB2C6D20E25 -30.7 4.77 -8.96 -0.27 0
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232153 87575609 1 SeO2H6C9 AB2C6D9 -43.15 5.37 -8.86 -1.09 0
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232154 87575610 1 C12O13H22 A12B13C22 -456.17 3.02 -10.3 -1.84 0
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232156 87575616 1 Cl3N8O10C46H55 A3B8C10D46E55 -333.14 15.13 -8.81 -1.61 0
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232157 87575618 1 ClO2N5C19H26 AB2C5D19E26 -47.19 4.36 -8.61 -0.26 0
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232158 87575621 1 ClION5C17H19 ABCD5E17F19 40.59 3.41 -8.71 -0.88 0
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232159 87575622 1 O8N10C11H22 A8B10C11D22 10.16 10.3 -10.11 -1.05 0
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232160 87575628 1 S3O28C56H84 A3B28C56D84 -1338.33 4.33 -8.75 0.14 0
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232161 87575629 1 N2S2O6C11H22 A2B2C6D11E22 -271.53 3.89 -8.63 0.16 0
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232162 87575630 1 N2O2C15H24 A2B2C15D24 -87.86 6.41 -10.36 0.34 0
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232163 87575632 1 CuN2Se2O4C6H10 AB2C2D4E6F10 -35.06 4.4 0.0 0.0 0
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232164 87575633 1 CuNSeO2C3H6 ABCD2E3F6 55.87 7.85 -7.85 -2.79 0
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232165 87575634 1 N2C15H34 A2B15C34 -55.02 1.48 -8.26 2.87 0
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232166 87575635 1 NP2O6C8H19 AB2C6D8E19 -398.36 5.24 -10.25 0.57 0
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232167 87575636 2 NO4H5C8 AB4C5D8 -86.69 3.83 -10.25 -1.8 0
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232168 87575637 1 ClO3F6H15C20 AB3C6D15E20 -400.1 6.25 -9.66 -1.1 -1
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232169 87575638 1 NH6O6C10 AB6C6D10 -61.89 6.09 0.0 0.0 0
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232170 87575639 1 OSeH6C9 ABC6D9 11.53 3.25 -8.81 -1.03 0
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232171 87575640 1 O10C51H100 A10B51C100 -642.82 4.83 -10.14 0.57 0
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232172 87575641 1 BrClNO3C16H23 ABCD3E16F23 -150.48 5.87 -9.88 -0.64 0
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232173 87575642 1 AgOC9H16 ABC9D16 -59.17 2.72 0.0 0.0 0
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232174 87575643 2 O2C22H39 A2B22C39 -268.2 11.04 -9.46 -0.83 -6
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232176 87575646 1 O2H30C35 A2B30C35 64.12 3.55 -9.01 -0.41 0
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232177 87575648 1 ClO2N5C18H22 AB2C5D18E22 -51.4 6.92 -8.98 -0.27 0
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232178 87575649 1 OSiC3Cl3H6 ABC3D3E6 -110.92 4.71 0.0 0.0 0
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232179 87575650 1 OSiC3Cl3H7 ABC3D3E7 -146.84 3.67 -9.8 -0.04 0
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232180 87575651 1 OSeC12H14 ABC12D14 -19.75 1.43 -8.42 -0.12 0
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232181 87575652 1 OSiC3Cl3H5 ABC3D3E5 -112.27 2.15 -8.75 -0.21 0
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232182 87575653 1 OSiC3Cl3H5 ABC3D3E5 -111.39 1.17 -8.77 -0.15 0
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232183 87575654 1 ClO2N5C18H22 AB2C5D18E22 -52.26 6.43 -8.93 -0.3 0
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232184 87575656 1 IN2O3C6H9 AB2C3D6E9 -61.18 2.88 -9.96 -2.2 0
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232185 87575659 1 O6H20C21 A6B20C21 -184.34 2.6 -9.55 -0.75 0
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232186 87575664 1 SN2O3C24H28 AB2C3D24E28 -75.72 7.69 -9.42 -0.57 -6