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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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141263 52850302 1 ClSN2O2C23H23 ABC2D2E23F23 -34.67 4.68 -9.42 -1.05 0
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141264 52850600 1 F2N2O3H18C20 A2B2C3D18E20 -171.5 9.25 -8.93 -1.02 0
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141265 52850782 1 BrNOF2H18C19 ABCD2E18F19 -78.91 3.06 -9.44 -0.51 0
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141266 52850783 1 F2O3N4C15H16 A2B3C4D15E16 -92.08 8.6 -9.94 -0.88 0
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141267 52850887 1 FOSN2H15C18 ABCD2E15F18 -7.35 7.11 -9.38 -1.0 0
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141268 52850911 1 NO3C18H21 AB3C18D21 -77.46 5.74 -8.5 -0.15 0
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141269 52850962 1 N2O2F3C15H17 A2B2C3D15E17 -230.89 7.62 -8.99 0.01 0
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141270 52851085 1 SN3O3C19H21 AB3C3D19E21 -64.83 6.15 -9.02 -0.45 0
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141271 52851086 1 SO2N3C21H23 AB2C3D21E23 -43.74 3.67 -8.74 -1.02 0
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141272 52851087 1 N2O2C19H20 A2B2C19D20 -48.8 4.85 -8.62 -0.26 0
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141273 52851224 1 N2O5C23H28 A2B5C23D28 -153.98 3.32 -8.98 -0.22 0
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141274 52851676 1 BrClFN2O2H11C15 ABCD2E2F11G15 -93.23 5.0 -8.96 -1.32 0
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141275 52851707 1 BrN2O3H17C21 AB2C3D17E21 -44.71 8.31 -8.94 -0.76 0
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141276 52851725 1 ON4C24H30 AB4C24D30 7.22 5.89 -8.24 0.09 0
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141277 52851726 1 ON4C24H30 AB4C24D30 6.42 5.01 -8.36 0.03 0
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141278 52852071 1 N3O3C21H31 A3B3C21D31 -139.04 2.91 -8.13 0.12 0
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141279 52852396 1 FO3N4C26H29 AB3C4D26E29 -82.32 5.26 -8.75 -0.72 0
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141280 52852477 1 FNSO5C19H20 ABCD5E19F20 -210.15 8.98 -8.31 -0.85 0
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141281 52852685 2 ClNSO2C8H9 ABCD2E8F9 -147.3 1.27 -8.58 -0.83 -1
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141282 52852804 1 SN4O4C17H19 AB4C4D17E19 -57.82 7.93 0.0 0.0 1
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141283 52853079 1 ClO2N3C16H27 AB2C3D16E27 -61.74 8.97 0.0 0.0 0
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141284 52853102 1 N2O5C18H26 A2B5C18D26 -200.78 6.71 -9.2 -0.48 0
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141285 52853298 1 SN2O3C21H26 AB2C3D21E26 -108.57 3.59 -8.9 -1.03 1
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141286 52854506 1 N2O4C22H29 A2B4C22D29 -94.74 1.9 0.0 0.0 0
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141287 52854507 2 NO2C11H14 AB2C11D14 -96.7 3.59 -8.47 0.04 1
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141288 52854508 1 SO2N4C26H29 AB2C4D26E29 23.96 4.73 0.0 0.0 1
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141289 52854610 1 N2O2C13H21 A2B2C13D21 -69.44 2.99 0.0 0.0 1
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141290 52854709 1 N3O3C23H38 A3B3C23D38 -126.74 3.44 0.0 0.0 1
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141291 52854731 1 N3O3C22H36 A3B3C22D36 -112.92 6.33 0.0 0.0 1
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141292 52854741 1 N2O2C21H33 A2B2C21D33 -35.19 3.64 0.0 0.0 1
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141293 52854751 1 FOSN3C24H27 ABCD3E24F27 11.13 18.38 0.0 0.0 0
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141294 52854802 1 O2N3C27H31 A2B3C27D31 -8.3 2.71 -8.98 -0.5 0
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141295 52855302 1 ON4C21H22 AB4C21D22 70.08 1.78 -8.93 -1.11 1
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141296 52855875 1 NOSC19H26 ABCD19E26 13.74 1.06 0.0 0.0 0
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141297 52855876 1 NOSC19H25 ABCD19E25 -0.01 4.37 -8.04 0.17 1
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141298 52855877 1 NOSC19H26 ABCD19E26 13.54 6.15 0.0 0.0 0
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141299 52855878 1 NOSC19H25 ABCD19E25 -2.86 3.72 -8.1 0.08 0
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141300 52856128 1 N3O3C23H35 A3B3C23D35 -136.44 3.15 -8.9 0.09 1
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141301 52856514 3 NOC8H8 ABC8D8 43.19 11.97 0.0 0.0 0
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141302 52856515 1 N3O3H23C24 A3B3C23D24 24.51 9.98 -9.23 -1.19 1
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141303 52856752 1 OSN5C27H34 ABC5D27E34 75.13 3.51 0.0 0.0 1
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141304 52856796 1 O3N4C25H33 A3B4C25D33 8.61 33.43 0.0 0.0 0
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141305 52857754 1 ClSN2O4C14H19 ABC2D4E14F19 -117.76 7.08 -9.17 -1.42 0
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141306 52857755 1 SF3O3N4C19H23 AB3C3D4E19F23 -230.67 6.19 -8.86 -0.57 0
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141307 52857764 1 FNSO3C14H20 ABCD3E14F20 -158.95 2.85 -9.39 -0.18 0
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141308 52858084 1 ClSN2O5C20H21 ABC2D5E20F21 -145.6 4.94 -9.55 -1.71 0
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141309 52858158 1 SN3O3C21H27 AB3C3D21E27 -77.11 3.9 -8.08 -0.74 1
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141310 52858355 1 FSO2N4C20H24 ABC2D4E20F24 -20.22 3.84 0.0 0.0 0
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141311 52858356 1 FSO2N4C20H23 ABC2D4E20F23 -41.56 5.23 -8.78 -1.38 0
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141312 52858600 1 N3O5C18H21 A3B5C18D21 -99.64 7.21 -8.68 -1.08 0