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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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179810 76534453 1 SO3N6C10H12 AB3C6D10E12 45.25 4.51 -9.56 -1.07 0
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179811 76534493 1 FON6H23C25 ABC6D23E25 58.89 6.61 -9.03 -1.13 0
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179812 76534657 1 NOC24H31 ABC24D31 -36.12 5.1 -9.21 -0.24 0
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179813 76534757 1 ClNC12H18 ABC12D18 -14.69 5.04 -9.4 0.4 0
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179814 76534902 1 ClN5O6C34H42 AB5C6D34E42 -151.28 2.47 -8.8 -0.54 0
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179815 76535255 1 NO5C22H25 AB5C22D25 -89.93 3.01 -8.65 -0.54 0
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179816 76535451 2 ClON2C11H12 ABC2D11E12 -47.7 1.89 -9.26 -0.47 0
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179817 76535581 1 ClNSO3C24H28 ABCD3E24F28 -115.24 3.35 -8.71 -0.93 0
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179818 76535703 1 BrSN3C12H14 ABC3D12E14 40.97 3.94 -8.64 -0.94 2
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179819 76536300 1 NaO3N5C10H10 AB3C5D10E10 -54.25 6.45 -8.24 -0.89 1
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179820 76536301 1 O3N5C10H10 A3B5C10D10 11.24 4.37 0.0 0.0 0
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179821 76536302 1 ClNO3C17H18 ABC3D17E18 -96.15 5.72 -8.94 -0.25 0
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179822 76536303 1 ClSO4N5H18C20 ABC4D5E18F20 -8.86 7.32 -9.19 -1.51 0
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179823 76537426 1 NSO5F7C32H32 ABC5D7E32F32 -534.84 6.34 -9.44 -1.39 0
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179824 76537427 1 Cl2N4O5C33H36 A2B4C5D33E36 -143.63 2.69 -8.96 -0.45 0
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179825 76537428 1 Cl3N4O5C33H37 A3B4C5D33E37 -136.62 4.58 -8.96 -0.26 0
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179826 76538148 1 PN2O6C24H39 AB2C6D24E39 -341.38 5.04 -9.57 0.05 0
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179827 76538164 1 O5C19H26 A5B19C26 -221.47 6.57 -10.1 -0.38 0
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179828 76538366 1 O3N4C16H18 A3B4C16D18 -32.0 4.4 -8.91 -1.17 0
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179829 76538537 1 SO5N6C23H34 AB5C6D23E34 -164.79 6.58 -8.64 -0.46 0
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179830 76538591 1 SO4N6C25H38 AB4C6D25E38 -136.16 6.77 -8.55 -0.36 0
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179831 76538611 1 F3N4O4C29H29 A3B4C4D29E29 -171.3 6.87 -9.32 -0.65 0
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179832 76538842 1 FN4O4C25H37 AB4C4D25E37 -228.01 1.4 -9.08 -0.75 0
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179833 76539364 1 NC5H6 AB5C6 54.53 3.69 0.0 0.0 0
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179834 76539583 1 OF2N2H8C10 AB2C2D8E10 -80.6 6.09 -9.25 -0.95 0