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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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168512 74981339 1 N4O45C93H164 A4B45C93D164 -2185.24 9.04 -9.79 -0.77 0
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168513 74981569 1 O3N4C34H46 A3B4C34D46 -153.59 6.86 -8.55 -0.22 0
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168514 74981653 1 FO4C24H33 AB4C24D33 -156.34 7.81 -9.4 -0.96 0
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168515 74981946 1 SO3N5C25H27 AB3C5D25E27 0.91 8.56 -8.77 -1.23 0
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168516 74982009 1 N2O3C36H50 A2B3C36D50 -126.33 12.74 -9.35 -0.81 0
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168517 74982010 1 SN3O6C24H37 AB3C6D24E37 -235.8 4.97 -8.48 -0.84 -1
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168518 74982285 1 SP3N7O19C27H43 AB3C7D19E27F43 -985.84 14.1 0.0 0.0 0
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168519 74982389 1 FN2O4C17H21 AB2C4D17E21 -189.8 0.91 -9.46 -0.08 0
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168520 74982600 1 SO2N7C27H29 AB2C7D27E29 46.18 7.91 -9.41 -0.89 0
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168521 74982715 1 SO3N7C32H37 AB3C7D32E37 -19.03 9.38 -9.07 -0.96 0
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168522 74982716 2 OSN3C12H12 ABC3D12E12 59.29 9.29 -9.3 -1.11 0
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168523 74982717 1 SO2N8C30H30 AB2C8D30E30 83.72 6.78 -9.28 -0.59 0
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168524 74982718 1 SO4N6C30H32 AB4C6D30E32 -54.92 5.68 -9.28 -1.0 0
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168525 74982743 1 ClSO3N6C27H27 ABC3D6E27F27 2.58 3.95 -9.34 -0.79 0
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168526 74982744 1 FSO3N6C27H27 ABC3D6E27F27 -33.97 4.35 -9.35 -0.84 0
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168527 74982825 1 SO3N8C30H30 AB3C8D30E30 37.84 7.56 -9.58 -0.96 0
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168528 74982900 1 FN5O5C21H22 AB5C5D21E22 -144.73 7.71 -9.11 -1.98 0
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168529 74982901 1 F3N3O9H20C21 A3B3C9D20E21 -439.93 2.99 -9.84 -1.48 0
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168530 74982902 1 N3O7C19H19 A3B7C19D19 -201.23 3.33 -9.65 -1.53 0
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168531 74983236 1 SO2F4N7C21H23 AB2C4D7E21F23 -184.11 5.08 -8.42 -1.09 0
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168532 74983254 1 FOSN9C19H26 ABCD9E19F26 8.96 4.38 -8.5 -0.81 0
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168533 74983255 1 FOSN8C20H25 ABCD8E20F25 6.83 3.31 -8.92 -0.98 0
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168534 74983256 1 FOSN8C20H25 ABCD8E20F25 2.6 2.55 -8.82 -1.09 0
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168535 74983257 1 FOSN9C20H22 ABCD9E20F22 52.85 3.31 -9.01 -1.42 0
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168536 74983472 1 NOC28H49 ABC28D49 -52.96 0.58 -8.95 1.42 0