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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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163832 74380522 1 SF3N3O3H22C27 AB3C3D3E22F27 -165.28 4.45 -9.19 -1.32 0
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163833 74380523 1 SO3N5H23C25 AB3C5D23E25 4.79 4.8 -8.9 -0.93 0
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163834 74380524 1 OSN5C24H27 ABC5D24E27 51.43 4.44 -8.69 -0.86 0
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163835 74380525 1 SO3N5C24H27 AB3C5D24E27 -29.24 6.7 -8.82 -0.99 0
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163836 74380526 1 OSN7C23H23 ABC7D23E23 87.68 9.72 -8.98 -1.0 0
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163837 74380529 1 O5N10C44H54 A5B10C44D54 -136.05 1.92 -8.35 -0.58 0
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163838 74380531 1 N2O13C43H76 A2B13C43D76 -619.4 4.77 -8.49 0.32 0
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163839 74380532 1 N2O12C41H76 A2B12C41D76 -607.23 4.99 -8.31 0.42 0
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163840 74380533 1 N2O14C45H78 A2B14C45D78 -662.92 3.8 -8.42 0.52 0
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163841 74380534 1 ClNO3C19H24 ABC3D19E24 -56.12 4.14 -9.08 -0.17 0
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163842 74380535 2 ON4C11H16 AB4C11D16 -13.16 7.83 -8.24 -0.1 0
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163843 74380536 1 O2N9C27H41 A2B9C27D41 3.28 2.87 -7.99 0.04 0
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163845 74380538 1 SN3O4C19H21 AB3C4D19E21 -63.91 5.72 -8.51 -0.79 0
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163846 74380539 1 N3O6C22H23 A3B6C22D23 -133.77 5.86 -8.53 -0.81 0
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163847 74380543 1 S3N5O15C38H57 A3B5C15D38E57 -623.31 15.89 -9.07 -0.54 0
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163848 74380544 2 SN2O6C20H29 AB2C6D20E29 -495.78 8.2 -8.91 -0.41 0
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163849 74380546 1 N3O3C35H37 A3B3C35D37 17.07 3.81 -8.67 -0.62 0
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163850 74380547 1 N3O3C31H35 A3B3C31D35 -1.67 2.76 -8.73 -0.71 0
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163851 74380552 2 O3C13H25 A3B13C25 -322.13 3.9 -9.47 0.5 0
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163853 74380554 1 NaSO4C19H37 ABC4D19E37 -150.75 110.03 -6.5 -3.9 0
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163854 74380555 1 SO4C19H38 AB4C19D38 -231.91 2.98 -9.74 0.08 0
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163855 74380556 2 O4C13H25 A4B13C25 -431.26 4.72 -9.61 0.33 0
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163856 74380557 1 NSO3C22H37 ABC3D22E37 -157.41 1.14 -9.78 -0.92 0
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163857 74380558 1 O2N4C21H22 A2B4C21D22 -14.46 7.11 -8.84 -0.36 0
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163860 74380561 1 OSeN2S2C5H7 ABC2D2E5F7 75.73 4.22 0.0 0.0 1