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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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214370 84981713 1 BrOSN3C17H26 ABCD3E17F26 -29.59 7.1 -8.59 -0.85 0
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214371 84981714 1 OSF2N3C16H23 ABC2D3E16F23 -110.23 4.33 -8.65 -1.3 0
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214372 84981715 1 SO3N4C17H26 AB3C4D17E26 -34.23 6.98 -8.75 -1.81 0
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214373 84981718 1 SO2N3C18H29 AB2C3D18E29 -67.37 6.06 -8.8 -0.55 0
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214374 84981742 1 ON3S3C19H29 AB3C3D19E29 -18.98 9.08 -8.52 -1.05 0
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214375 84981758 1 BrFOSN3C16H23 ABCDE3F16G23 -65.39 2.85 -8.84 -0.93 0
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214376 84981768 1 FSO3N5C19H26 ABC3D5E19F26 -107.61 7.16 -8.62 -1.5 0
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214377 84981772 1 SO3N4C21H28 AB3C4D21E28 -67.36 10.28 -8.47 -1.23 0
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214378 84981774 1 OS2N3C17H27 AB2C3D17E27 -22.45 8.95 -8.54 -0.81 0
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214379 84981780 1 S2O3N4C19H30 A2B3C4D19E30 -105.88 12.64 -8.43 -0.77 0
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214380 84981785 1 SN2O5C14H18 AB2C5D14E18 -191.26 7.17 -9.95 -1.32 0
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214381 84981791 1 SN2O5C17H20 AB2C5D17E20 -169.24 4.36 -8.41 -1.45 0
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214382 84981792 1 SO3N4C19H28 AB3C4D19E28 -105.46 7.03 -8.51 -0.93 0
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214383 84981797 1 SN2O5C16H18 AB2C5D16E18 -174.6 2.27 -8.63 -1.62 0
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214384 84981802 1 OSN5C20H29 ABC5D20E29 19.18 9.34 -8.59 -1.32 0
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214385 84981807 1 SO3N4C19H28 AB3C4D19E28 -98.11 4.17 -8.66 -0.68 0
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214386 84981814 1 BrFOSN3C16H23 ABCDE3F16G23 -68.12 6.74 -8.65 -1.42 1
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214387 84981820 1 SN3O4C19H28 AB3C4D19E28 -35.52 9.86 0.0 0.0 0
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214388 84981824 1 FSO2N5C20H28 ABC2D5E20F28 -56.26 4.44 -8.86 -0.94 0
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214389 84981826 1 SN4O4C18H28 AB4C4D18E28 -181.26 8.05 -9.21 -0.52 1
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214390 84981830 1 O3N4C23H31 A3B4C23D31 -78.22 4.06 0.0 0.0 0
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214391 84981832 1 ClN2O4C20H23 AB2C4D20E23 -124.94 2.21 -9.12 -0.36 0
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214392 84981833 1 N4O5C15H22 A4B5C15D22 -180.47 4.3 -9.12 -0.54 0
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214393 84981844 2 NOC13H15 ABC13D15 -32.49 3.06 -8.29 -0.33 0
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214394 84981846 1 NO5C21H23 AB5C21D23 -170.06 1.77 -8.44 -0.03 0