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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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81143 49854397 1 ON9C18H23 AB9C18D23 50.01 4.23 -8.27 -0.37 0
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81144 49854398 2 OF2N2C10H11 AB2C2D10E11 -238.88 2.44 -9.1 -0.52 0
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81145 49854400 1 O2F3N4C19H21 A2B3C4D19E21 -196.57 3.85 -8.93 -0.26 0
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81146 49854401 1 ClO2F3N4C18H18 AB2C3D4E18F18 -197.3 2.02 -9.07 -0.62 0
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81147 49854402 1 O2N4F6H18C19 A2B4C6D18E19 -348.57 1.38 -9.12 -1.01 0
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81148 49854404 1 BrN2O3H19C22 AB2C3D19E22 -13.2 3.05 -8.75 -0.62 0
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81149 49854405 1 FN2O3H19C22 AB2C3D19E22 -56.82 5.47 -8.75 -0.51 0
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81150 49854406 1 FSN3O5C21H26 ABC3D5E21F26 -174.7 3.62 -9.31 -0.64 0
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81151 49854407 1 SN3O5C22H29 AB3C5D22E29 -133.74 4.95 -8.61 -0.52 0
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81152 49854408 1 SN3O5C25H29 AB3C5D25E29 -110.85 4.27 -9.13 -0.72 0
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81153 49854409 1 SCl2N3O5C21H25 AB2C3D5E21F25 -144.43 5.04 -9.35 -0.78 0
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81154 49854411 1 SCl2N3O5C21H25 AB2C3D5E21F25 -142.37 8.81 -9.36 -1.01 0
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81155 49854412 1 N5O5H23C28 A5B5C23D28 -53.07 7.76 -9.46 -1.34 0
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81156 49854413 5 NOC7H7 ABC7D7 -83.24 4.35 -8.64 -0.9 0
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81157 49854414 1 F2O3N5H37C40 A2B3C5D37E40 -86.14 8.81 -8.95 -0.83 0
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81158 49854415 1 F2O3N5H33C38 A2B3C5D33E38 -95.46 6.15 -9.2 -0.84 0
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81159 49854416 1 ON2C19H20 AB2C19D20 37.07 0.73 -8.23 -0.09 0
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81160 49854417 1 SN2C17H24 AB2C17D24 39.75 1.25 -8.54 0.15 0
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81161 49854418 1 OSN2C17H20 ABC2D17E20 21.97 1.59 -8.25 -0.51 0
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81162 49854419 1 O2N3C23H27 A2B3C23D27 -12.37 3.58 -8.39 0.14 0
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81163 49854420 1 N2O3C20H28 A2B3C20D28 -109.76 2.25 -8.42 0.19 0
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81164 49854421 1 O2N3C18H25 A2B3C18D25 -40.13 3.12 -8.31 0.26 0
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81165 49854422 1 ON2C18H24 AB2C18D24 21.33 1.43 -8.27 0.28 0
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81166 49854423 1 N2O3C18H24 A2B3C18D24 -92.25 3.15 -8.36 0.2 0
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81167 49854424 1 O3N4C19H22 A3B4C19D22 -75.76 7.93 -9.12 -0.4 0
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81168 49854425 1 O3N4C19H22 A3B4C19D22 -78.12 7.7 -9.16 -0.4 0
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81169 49854426 1 O3N4C20H24 A3B4C20D24 -87.49 5.88 -8.88 -0.56 0
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81170 49854427 4 NOC5H6 ABC5D6 -115.19 5.62 -9.11 -0.44 0
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81171 49854428 4 NOC5H6 ABC5D6 -113.97 9.44 -9.13 -0.42 0
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81172 49854429 1 O4N5C19H21 A4B5C19D21 -107.53 11.19 -9.08 -0.64 0
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81173 49854430 1 O3N4C20H24 A3B4C20D24 -86.73 6.53 -8.94 -0.37 0
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81174 49854431 1 O3N4H22C25 A3B4C22D25 -33.94 4.86 -9.41 -0.9 0
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81175 49854432 1 O3N4H24C26 A3B4C24D26 -43.23 7.25 -9.17 -0.68 0
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81176 49854433 1 ON4C18H18 AB4C18D18 16.86 7.43 -9.24 -0.68 0
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81177 49854434 1 N5O5C27H33 A5B5C27D33 -200.8 8.94 -9.0 -0.84 0
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81178 49854435 1 O3N5C22H25 A3B5C22D25 -90.88 11.6 -8.72 -0.66 0
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81179 49854436 1 O3N5C22H25 A3B5C22D25 -89.38 9.17 -8.91 -0.77 0
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81180 49854437 1 NaS2N6O11C19H27 AB2C6D11E19F27 -457.46 5.74 -8.91 -0.96 0
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81181 49854438 1 O7C27H34 A7B27C34 -261.11 5.97 -9.71 -1.39 2
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81182 49854439 1 MgSO2F3N3H14C16 ABC2D3E3F14G16 -146.83 6.88 -5.87 -0.73 2
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81183 49854440 1 MgSO2F3N3H14C16 ABC2D3E3F14G16 -150.07 4.43 -6.07 -0.86 0
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81184 49854441 2 NO12C25H47 AB12C25D47 -1154.87 6.99 -8.61 -0.53 0
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81185 49854442 1 SF2O2N5H15C17 AB2C2D5E15F17 -72.68 4.05 -8.66 -0.53 0
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81186 49854443 1 BrSO4N5C19H20 ABC4D5E19F20 -65.73 6.27 -8.44 -0.79 0
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81187 49854444 1 FSO3N5C18H18 ABC3D5E18F18 -66.22 3.4 -8.38 -0.38 0
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81188 49854445 1 BrSO4N5C19H20 ABC4D5E19F20 -62.26 5.41 -8.45 -0.51 0
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81189 49854446 1 SO2F3N5H14C17 AB2C3D5E14F17 -121.15 7.09 -8.83 -0.75 0
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81190 49854447 1 SO2F3N5H14C17 AB2C3D5E14F17 -119.29 4.92 -8.82 -0.66 0
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81191 49854448 1 O2N7C30H43 A2B7C30D43 -25.6 1.56 -8.67 0.08 0
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81192 49854449 1 O2N7C31H45 A2B7C31D45 -25.07 7.94 -8.62 0.04 0