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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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339979 127261988 1 N3O4C26H35 A3B4C26D35 -151.58 4.89 -9.19 -0.23 0
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339980 127261989 1 N3O4C25H25 A3B4C25D25 -100.08 3.32 -9.53 -0.1 0
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339981 127261990 1 SO2N4C17H18 AB2C4D17E18 -7.83 6.7 -8.78 -1.27 0
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339982 127261991 1 NO4C12H15 AB4C12D15 -152.66 5.32 -9.79 -0.12 0
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339983 127261992 1 SN2O3C13H16 AB2C3D13E16 -97.39 2.96 -8.9 -0.16 0
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339984 127261993 1 N4O4C19H32 A4B4C19D32 -204.46 5.42 -9.25 0.05 0
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339985 127261994 1 N4O5C21H30 A4B5C21D30 -188.4 5.29 -9.85 -0.53 0
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339986 127261995 1 O4N5C27H39 A4B5C27D39 -166.42 3.26 -8.99 0.04 0
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339987 127261996 1 N5O6C23H33 A5B6C23D33 -229.61 6.77 -9.25 -0.56 0
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339988 127261997 1 IO3N4C25H33 AB3C4D25E33 -98.09 5.32 -9.26 -1.1 0
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339989 127261998 1 IO3N4C25H33 AB3C4D25E33 -99.24 2.55 -9.46 -0.99 0
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339990 127261999 1 IO3N4C25H33 AB3C4D25E33 -99.81 1.79 -9.47 -1.0 0
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339991 127262000 1 IO3N4C25H33 AB3C4D25E33 -101.27 2.65 -9.31 -1.11 0
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339992 127262001 1 IO3N4C25H33 AB3C4D25E33 -96.31 6.28 -9.33 -0.8 0
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339993 127262002 1 IO3N4C25H33 AB3C4D25E33 -101.23 3.8 -9.28 -0.8 0
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339994 127262003 1 N3O5C14H25 A3B5C14D25 -253.85 2.03 -9.66 0.19 0
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339995 127262004 1 N4O5C26H34 A4B5C26D34 -201.5 6.68 -9.27 0.19 0
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339996 127262005 2 N2O2C9H15 A2B2C9D15 -204.04 6.89 -9.43 0.47 0
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339997 127262006 1 SN4O4C18H32 AB4C4D18E32 -218.02 4.46 -8.48 -0.11 0
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339998 127262007 2 O2N4C11H16 A2B4C11D16 -136.79 4.23 -9.38 -0.32 0
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339999 127262008 2 BrN2O2C10H15 AB2C2D10E15 -185.65 3.16 -9.41 -0.85 0
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340000 127262009 1 N4O4C15H26 A4B4C15D26 -198.88 6.78 -9.78 0.36 0
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340001 127262010 1 SO3N4C15H26 AB3C4D15E26 -149.44 6.16 -8.87 -0.42 0
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340002 127262011 1 O3N8C17H26 A3B8C17D26 -84.34 1.68 -9.4 0.12 0
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340003 127262012 1 O3N8C21H26 A3B8C21D26 -49.41 4.48 -9.3 -0.29 0
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340004 127262013 1 O3N4C16H30 A3B4C16D30 -173.08 7.45 -9.29 0.57 0
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340005 127262014 1 SO3N4C14H24 AB3C4D14E24 -142.03 1.65 -9.22 0.22 0
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340006 127262015 1 O5N7C24H31 A5B7C24D31 -167.29 8.33 -8.61 0.14 0
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340007 127262016 1 SN4O4C34H42 AB4C4D34E42 -124.29 10.28 -8.7 -0.08 0
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340008 127262017 1 N7O7C18H31 A7B7C18D31 -334.06 3.2 -9.97 0.13 0
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340009 127262018 1 N5O6C24H43 A5B6C24D43 -320.14 8.28 -9.59 0.23 0
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340010 127262019 1 N4O5C25H40 A4B5C25D40 -247.26 12.71 -8.24 -0.07 0
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340011 127262020 1 N5O5C15H27 A5B5C15D27 -250.97 5.71 -9.82 0.35 0
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340012 127262021 5 NOC3H5 ABC3D5 -233.36 6.64 -9.5 0.23 0
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340013 127262022 1 N7O7C18H29 A7B7C18D29 -317.0 8.5 -9.81 -0.08 0
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340014 127262023 1 O4N10C35H40 A4B10C35D40 -58.07 5.5 -8.64 -1.44 0
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340015 127262024 1 O6N10C41H54 A6B10C41D54 -184.49 7.55 -8.55 -1.37 0
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340016 127262025 1 N6O6C29H42 A6B6C29D42 -284.42 3.05 -8.27 0.18 0
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340017 127262026 1 N4O9C30H34 A4B9C30D34 -341.61 6.91 -9.51 -1.36 0
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340018 127262027 1 N4O5C21H30 A4B5C21D30 -214.79 4.47 -9.37 -0.33 0
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340019 127262028 1 N5O6C23H25 A5B6C23D25 -135.87 4.36 -9.91 -1.58 0
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340020 127262029 1 N7O8C22H31 A7B8C22D31 -259.15 7.98 -9.91 -1.5 0
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340021 127262030 1 O7N9C23H41 A7B9C23D41 -322.82 10.98 -9.07 0.01 0
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340022 127262031 1 O5N6C19H36 A5B6C19D36 -260.63 5.22 -9.62 0.37 0
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340023 127262032 1 O4N5C16H31 A4B5C16D31 -221.15 5.68 -9.46 0.32 0
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340024 127262033 1 PN4O6C11H23 AB4C6D11E23 -354.04 9.0 -9.82 0.12 0
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340025 127262034 1 N5O6C24H31 A5B6C24D31 -157.29 10.31 -9.27 -1.32 0
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340026 127262035 1 N5O5C23H27 A5B5C23D27 -97.3 3.8 -9.55 -1.6 0
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340027 127262036 1 O4N5C25H35 A4B5C25D35 -149.96 6.6 -8.36 -0.28 0
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340028 127262037 1 N4O7C21H30 A4B7C21D30 -290.8 10.83 -9.29 -0.3 0