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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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189491 77865548 2 ON2C13H16 AB2C13D16 -22.78 4.72 -9.09 0.16 0
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189492 77865549 1 FN2C26H27 AB2C26D27 15.41 2.88 -9.0 -0.56 0
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189493 77865550 1 NO4C16H27 AB4C16D27 -212.24 1.98 -9.8 -0.13 0
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189494 77865905 1 ClN2O4C35H39 AB2C4D35E39 -149.22 5.38 -9.18 -0.88 0
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189495 77865906 1 ClN2O3C24H35 AB2C3D24E35 -181.89 4.57 -9.14 -0.02 1
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189496 77866121 1 N2O13C31H51 A2B13C31D51 -621.03 2.17 0.0 0.0 0
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189497 77866179 1 N2O2C25H36 A2B2C25D36 -66.23 4.21 -8.5 -0.22 0
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189498 77866180 1 ON2C25H36 AB2C25D36 -37.12 3.21 -8.46 -0.11 0
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189499 77866200 1 O3N4H16C18 A3B4C16D18 24.88 1.34 -8.49 -0.49 0
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189500 77866354 1 OSN3C23H25 ABC3D23E25 34.76 3.44 -8.42 -0.82 0
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189501 77866487 1 ClN2O3C24H31 AB2C3D24E31 -143.14 4.13 -9.1 -1.0 0
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189502 77866546 1 SiO6C28H38 AB6C28D38 -299.85 1.45 -9.03 -0.07 0
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189503 77866969 1 F2N5O5C30H37 A2B5C5D30E37 -223.06 4.44 -8.88 -0.65 0
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189504 77866970 1 F2O4N5C28H35 A2B4C5D28E35 -182.54 4.36 -8.64 -0.55 0
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189505 77866971 1 ON7C27H29 AB7C27D29 89.56 3.75 -8.79 -0.38 0
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189506 77866972 1 F2O3N5C25H31 A2B3C5D25E31 -136.08 5.27 -8.97 -0.52 0
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189507 77866973 1 F2O3N5C24H27 A2B3C5D24E27 -126.62 2.39 -9.28 -0.68 0
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189508 77866974 1 FO3N5C25H30 AB3C5D25E30 -75.55 4.73 -8.51 -0.45 0
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189509 77866976 1 F2O2N7C26H31 A2B2C7D26E31 -64.64 5.6 -8.55 -0.68 0
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189510 77866991 1 NOF5C14H16 ABC5D14E16 -277.56 2.87 -9.56 -0.44 0
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189511 77867095 1 F2O2N6C29H32 A2B2C6D29E32 -54.58 7.32 -8.92 -0.49 0
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189512 77867198 1 BrSF2O4N6C29H35 ABC2D4E6F29G35 -175.9 6.93 -9.26 -0.94 0
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189513 77867602 1 F5O5N6H21C23 A5B5C6D21E23 -364.36 2.73 -9.33 -1.18 0
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189514 77867635 1 ClF2O3N9H20C23 AB2C3D9E20F23 -83.96 3.87 -8.46 -1.51 0
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189515 77867636 2 O2N3C11H12 A2B3C11D12 -114.68 6.19 -8.44 -0.41 0