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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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215612 85084985 1 NO15C61H103 AB15C61D103 -811.23 6.72 -8.98 0.14 0
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215613 85084986 1 PCl4N6O8C54H59 AB4C6D8E54F59 -281.05 4.95 -8.67 -0.63 0
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215614 85084987 1 O23C53H86 A23B53C86 -1100.78 6.64 -9.24 0.38 0
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215615 85084988 1 SN11O13C52H73 AB11C13D52E73 -556.01 1.93 -9.05 -0.16 0
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215616 85084989 1 SO11N18C46H80 AB11C18D46E80 -459.85 14.42 -8.48 -0.49 0
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215617 85084991 2 OPN2F6H22C28 ABC2D6E22F28 -611.66 6.42 -8.52 -0.87 0
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215618 85084992 2 IOC30H53 ABC30D53 -273.13 2.19 -8.71 -1.02 0
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215619 85084993 2 SBr2O8H12C18 AB2C8D12E18 -576.39 4.0 -8.74 -2.64 0
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215620 85084994 1 O11N14C54H76 A11B14C54D76 -472.48 12.0 -9.04 0.0 0
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215621 85084995 1 S2N10O13C51H72 A2B10C13D51E72 -581.57 9.27 -8.77 -0.44 0
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215622 85084996 1 N6O9C66H76 A6B9C66D76 -294.97 7.72 -8.79 -0.35 0
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215623 85084997 1 N4Br6O10H30C31 A4B6C10D30E31 -221.51 4.06 -9.46 -1.28 0
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215624 85084998 1 N4Br6O10H30C31 A4B6C10D30E31 -258.72 7.52 -9.01 -1.03 0
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215625 85084999 1 O23C54H82 A23B54C82 -1053.16 7.05 -9.31 -0.02 0
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215626 85085000 1 SN4O13C58H106 AB4C13D58E106 -800.78 6.52 -8.63 0.47 0
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215627 85085001 1 ClSO10C67H67 ABC10D67E67 -208.17 4.16 -8.51 -0.13 0
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215628 85085002 1 Cl2N2O4C69H108 A2B2C4D69E108 -222.7 4.42 -7.98 0.21 0
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215629 85085003 1 O13C68H76 A13B68C76 -394.9 4.58 -8.86 0.08 0
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215630 85085004 2 NO5C34H48 AB5C34D48 -253.49 12.16 -7.72 -0.2 0
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215631 85085006 2 O10C29H43 A10B29C43 -879.68 5.62 -9.41 -0.65 0
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215632 85085008 1 SCl2F9N10O11C39H47 AB2C9D10E11F39G47 -882.81 8.69 -9.0 -2.41 0
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215633 85085009 1 N11O14C54H79 A11B14C54D79 -647.64 13.92 -9.0 -0.05 0
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215634 85085011 2 SO5N6C27H33 AB5C6D27E33 -321.12 8.53 -8.46 -0.27 0
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215635 85085014 1 S2N12O17C46H60 A2B12C17D46E60 -702.64 13.97 -9.42 -0.71 0
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215636 85085015 1 SO13N16C49H64 AB13C16D49E64 -379.14 9.68 -7.19 -2.49 0