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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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180099 76577167 1 Na2S3N4O13C18H32 A2B3C4D13E18F32 -502.51 49.13 -7.9 -2.12 0
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180100 76577319 1 ZnN8O12H56C57 AB8C12D56E57 80.64 25.02 -8.45 -3.62 0
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180101 76577720 1 F3O3N5C29H30 A3B3C5D29E30 -160.72 6.9 -9.0 -1.62 0
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180102 76577964 2 SN2O2H7C10 AB2C2D7E10 -32.2 8.34 -8.74 -2.02 0
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180103 76577997 1 O3N4C38H44 A3B4C38D44 19.88 8.44 -8.8 -0.56 0
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180104 76577998 1 F3O3N4H35C40 A3B3C4D35E40 -98.66 6.38 -8.84 -0.88 0
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180105 76578053 1 FN3O5C16H20 AB3C5D16E20 -205.88 6.35 -9.54 -0.59 0
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180106 76578616 1 S2O3N5C21H21 A2B3C5D21E21 -16.19 5.74 -9.04 -1.12 0
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180107 76578965 1 IrN3C16H16 AB3C16D16 312.12 18.99 -9.22 -4.71 0
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180108 76579582 1 FO4N6C31H35 AB4C6D31E35 -119.99 5.13 -8.83 -0.2 0
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180109 76579668 1 ClN2O3C10H11 AB2C3D10E11 -68.78 3.36 -9.64 -0.83 0
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180110 76579674 1 SF2N3O4C21H23 AB2C3D4E21F23 -203.09 2.57 -9.03 -0.64 0
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180111 76579710 1 SN3O4C21H25 AB3C4D21E25 -112.56 1.64 -8.56 -0.72 0
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180112 76579711 1 SN3O5C22H23 AB3C5D22E23 -121.38 1.36 -8.47 -0.95 -3
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180113 76579959 1 NPtC22H28 ABC22D28 212.84 1.32 0.0 0.0 0
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180114 76580104 2 NO4C17H22 AB4C17D22 -326.63 7.99 -9.19 -0.29 0
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180115 76580589 1 SN6O7C30H54 AB6C7D30E54 -342.9 6.35 -9.12 -0.52 0
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180116 76581196 2 ClO2C15H16 AB2C15D16 -148.08 4.89 -9.4 -0.87 0
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180117 76581398 1 N4O8C27H44 A4B8C27D44 -366.22 2.28 -9.59 0.22 0
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180118 76581399 1 N4O9C35H58 A4B9C35D58 -419.51 3.15 -9.35 0.03 0
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180119 76581440 1 N4O9C33H54 A4B9C33D54 -458.95 9.81 -9.56 0.16 0
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180120 76582218 1 SN3O8C21H31 AB3C8D21E31 -345.06 3.61 -10.02 -0.56 0
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180121 76582523 1 S2N6O12C37H50 A2B6C12D37E50 -495.77 6.06 -8.79 -0.73 0
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180122 76582524 2 SN3O5C18H21 AB3C5D18E21 -284.68 5.17 -9.27 -1.86 0
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180123 76582590 1 SN2F3O7C27H27 AB2C3D7E27F27 -332.33 8.34 -8.86 -1.72 0
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180124 76582591 1 O2S2F3N3H20C23 A2B2C3D3E20F23 -148.49 6.09 -8.76 -1.3 0
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180125 76582593 1 BrSN2F3O3H16C22 ABC2D3E3F16G22 -179.22 4.13 -9.15 -1.59 0
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180126 76582625 1 NO2H11C15 AB2C11D15 -0.96 5.11 -9.93 -1.08 0
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180127 76582626 1 SO3N4H24C26 AB3C4D24E26 -0.96 7.66 -7.99 -1.22 0
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180128 76582643 1 ON3C23H23 AB3C23D23 34.62 6.76 -8.25 -0.48 0
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180129 76582782 1 ClSN3O3C24H24 ABC3D3E24F24 -69.51 4.05 -8.95 -0.43 0
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180130 76582783 1 SN3O3C26H29 AB3C3D26E29 -76.98 1.95 -8.51 -0.44 0
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180131 76582848 1 SO3N4H22C24 AB3C4D22E24 -27.18 5.59 -8.25 -0.57 0
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180132 76582966 1 OCl2N4C23H24 AB2C4D23E24 16.03 6.82 -9.44 -0.86 0
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180133 76582969 1 OCl2N5C23H25 AB2C5D23E25 5.39 8.36 -8.96 -0.7 0
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180134 76583116 1 Cl2O2N6C23H24 A2B2C6D23E24 -10.6 10.62 -8.96 -0.91 0
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180135 76583550 1 SN2Cl3O5H19C22 AB2C3D5E19F22 -146.03 5.2 -9.39 -1.06 0
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180136 76583585 2 NSO2C8H10 ABC2D8E10 -138.8 7.77 -9.1 -0.72 0
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180137 76583675 1 FO2N3C22H32 AB2C3D22E32 -138.07 5.35 -8.91 -0.09 0
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180138 76583676 1 N2O2C17H22 A2B2C17D22 -33.27 7.53 -8.9 -1.12 0
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180139 76583677 1 ClN2O2C21H21 AB2C2D21E21 -6.1 8.17 -9.0 -1.05 0
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180140 76583906 1 ClN2O2C18H23 AB2C2D18E23 -46.3 8.53 -9.06 -1.78 0
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180141 76584155 1 S5N10O16C41H42 A5B10C16D41E42 -147.62 10.43 -8.11 -2.61 0
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180142 76584284 1 ClS5N10O15H31C36 AB5C10D15E31F36 -121.01 6.94 -8.06 -2.47 2
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180143 76584385 4 NH18C19 AB18C19 299.01 29.81 -4.69 -2.43 0
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180144 76584602 1 F2N4O7C37H44 A2B4C7D37E44 -342.18 7.51 -9.33 -0.66 0
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180145 76584783 1 ClON4C25H33 ABC4D25E33 -13.14 6.47 -8.75 -0.14 0
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180146 76584812 1 Cl2O3N5C23H33 A2B3C5D23E33 -126.85 3.55 -8.93 -0.44 0
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180147 76584952 1 Cl2O2F3N5C20H26 A2B2C3D5E20F26 -238.27 4.04 -9.14 -0.64 0
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180148 76585876 1 RuN4C8H12 AB4C8D12 271.13 10.31 -6.88 -3.0 0