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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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173336 75624922 1 SN2O2C14H14 AB2C2D14E14 -11.09 3.79 -9.2 -1.06 0
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173337 75624923 1 FN2O2H15C16 AB2C2D15E16 -63.5 2.7 -9.24 -0.86 0
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173338 75625375 1 SO2N5C14H21 AB2C5D14E21 -45.4 4.9 -8.87 -0.46 0
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173339 75625376 1 NF2O4C20H21 AB2C4D20E21 -199.54 4.8 -9.03 -0.78 0
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173340 75625377 1 FO2N5H16C20 AB2C5D16E20 18.38 3.66 -9.48 -1.7 0
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173341 75625500 1 ClO2N5C18H20 AB2C5D18E20 8.99 5.38 -9.46 -1.96 0
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173342 75625591 1 ClFON3C17H19 ABCD3E17F19 -33.0 2.37 -9.15 -0.44 0
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173343 75625592 1 OSN2C17H20 ABC2D17E20 6.79 3.65 -9.22 -0.92 0
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173344 75625593 1 ClN3O3C18H20 AB3C3D18E20 -49.26 5.0 -8.83 -0.32 0
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173345 75625594 1 OSF3N5H10C14 ABC3D5E10F14 -64.93 3.51 -9.49 -2.17 0
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173346 75625759 4 ON2C4H6 AB2C4D6 -84.96 9.43 -10.09 -0.98 0
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173347 75625760 4 ON2C4H6 AB2C4D6 -87.02 7.89 -10.23 -1.04 0
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173348 75625761 1 O3N8C16H24 A3B8C16D24 -49.23 3.43 -10.34 -1.33 0
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173349 75625762 1 ClOSN6H13C16 ABCD6E13F16 88.67 6.43 -9.1 -1.13 0
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173350 75625780 1 ClN3O3C20H26 AB3C3D20E26 -152.18 5.44 -9.68 -0.47 0
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173351 75625900 1 ClO2N3H14C16 AB2C3D14E16 2.07 4.23 -8.91 -1.38 0
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173352 75626396 1 O2S2N3H13C14 A2B2C3D13E14 19.2 3.71 -9.1 -2.01 0
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173353 75626397 1 ClFSO2N3H11C15 ABCD2E3F11G15 -36.07 3.76 -9.5 -1.87 0
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173354 75626531 1 SO4N5C17H23 AB4C5D17E23 -84.85 6.52 -8.82 -0.23 1
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173355 75626979 1 N4O4C19H23 A4B4C19D23 -83.82 1.13 0.0 0.0 1
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173356 75626980 1 BrO4N6C11H14 AB4C6D11E14 -132.09 6.86 0.0 0.0 0
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173357 75627153 1 O2N3C23H25 A2B3C23D25 -8.37 1.7 -9.19 -1.41 0
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173358 75627157 1 N2O2H20C21 A2B2C20D21 2.69 3.6 -9.24 -1.19 1
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173359 75627158 1 N3O3C22H22 A3B3C22D22 -40.55 2.17 0.0 0.0 0
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173360 75627159 1 SO2N3C22H23 AB2C3D22E23 -4.73 6.29 -9.06 -1.9 0