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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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194470 78541329 1 F3N3O3H16C18 A3B3C3D16E18 -197.41 7.12 -8.94 -1.08 0
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194471 78541413 1 NSO6C9H17 ABC6D9E17 -267.1 9.94 -9.77 -0.9 0
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194472 78541755 1 FN2O6H15C18 AB2C6D15E18 -151.0 5.7 -9.02 -1.62 0
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194473 78541855 1 BrNO2H20C22 ABC2D20E22 -28.94 3.1 -8.98 -0.92 0
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194474 78542025 1 ClO2H17C22 AB2C17D22 -8.74 2.3 -9.38 -0.84 0
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194475 78542041 1 ClN2O4H19C20 AB2C4D19E20 -129.98 7.54 -8.4 -1.28 0
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194476 78542548 1 O3N4H20C23 A3B4C20D23 19.95 4.55 -9.06 -0.93 0
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194477 78542828 1 NO3C20H23 AB3C20D23 -107.45 4.88 -8.65 -0.08 0
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194478 78543081 1 NO7C21H21 AB7C21D21 -208.79 5.8 -8.4 -1.1 0
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194479 78543662 1 SN4O5C19H24 AB4C5D19E24 -142.79 13.54 -9.16 -1.02 0
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194480 78543663 1 N3O5C18H19 A3B5C18D19 -131.47 6.46 -8.35 -0.85 0
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194481 78543747 1 SN3O3H21C23 AB3C3D21E23 -26.18 4.04 -8.28 -0.49 0
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194482 78543748 1 N3O4C23H23 A3B4C23D23 -75.21 6.61 -8.46 -0.85 0
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194483 78544044 1 NO5H17C19 AB5C17D19 -136.74 6.66 -9.31 -1.38 0
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194484 78544045 1 N3O5C16H19 A3B5C16D19 -192.61 4.43 -8.99 -0.13 0
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194485 78544054 1 N3O5C20H21 A3B5C20D21 -181.15 6.06 -8.57 -0.5 0
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194486 78544055 1 N3O5C20H27 A3B5C20D27 -213.05 5.73 -8.68 -0.22 0
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194487 78544230 1 N2O5C20H20 A2B5C20D20 -74.56 4.2 -9.58 -1.6 0
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194488 78544392 1 ClN2O5H17C18 AB2C5D17E18 -106.86 4.68 -9.74 -1.64 0
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194489 78544670 1 ClN2O4C20H21 AB2C4D20E21 -142.22 3.64 -8.5 -1.22 0
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194490 78544723 1 NSO6H17C19 ABC6D17E19 -166.5 6.7 -9.41 -0.84 0
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194491 78544724 1 N2O5C20H22 A2B5C20D22 -175.72 6.83 -8.42 -0.94 1
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194492 78544725 1 OS2N5C19H26 AB2C5D19E26 67.53 6.72 0.0 0.0 0
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194493 78545115 1 NSO4C20H23 ABC4D20E23 -148.96 3.19 -8.68 -1.14 0
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194494 78545313 1 ClF2N3O3H16C19 AB2C3D3E16F19 -186.35 7.64 -8.87 -1.17 0