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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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217977 85088682 1 BrOSN4H17C18 ABCD4E17F18 47.19 1.64 -8.39 -1.05 0
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217978 85088683 1 F2O4N7C17H17 A2B4C7D17E17 -148.6 7.73 -8.98 -0.91 0
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217979 85088684 1 NSO9H11C18 ABC9D11E18 -292.24 2.87 -8.87 -1.74 0
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217980 85088686 1 NPO4C23H32 ABC4D23E32 -188.73 4.7 -9.49 -0.22 0
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217981 85088687 1 SN3O5C20H23 AB3C5D20E23 -91.79 9.22 -8.59 -0.95 0
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217982 85088689 1 NO2H23C29 AB2C23D29 106.27 2.13 -8.99 -0.35 0
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217983 85088690 1 NSO3H23C25 ABC3D23E25 -45.77 1.37 -8.47 -0.36 0
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217984 85088694 1 ClSN3O4C18H28 ABC3D4E18F28 -185.85 7.19 -9.0 -1.29 0
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217985 85088695 1 FIO3N4H12C13 ABC3D4E12F13 -69.94 15.14 -9.59 -2.2 0
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217986 85088696 1 NCl2O3H21C22 AB2C3D21E22 -78.06 1.91 -8.29 -0.4 0
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217987 85088700 1 N4O4H22C23 A4B4C22D23 -59.9 3.47 -8.67 -0.41 0
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217988 85088701 1 O2N8C21H24 A2B8C21D24 34.32 5.69 -9.37 -0.88 0
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217989 85088702 1 SO5H18C24 AB5C18D24 -17.95 3.78 -8.61 -1.92 0
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217990 85088703 1 SN2O5C21H26 AB2C5D21E26 -142.92 6.96 -8.49 -0.11 0
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217991 85088704 1 SN2O3H22C24 AB2C3D22E24 -62.3 1.92 -9.19 -0.77 0
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217992 85088705 2 O3C12H17 A3B12C17 -251.61 6.71 -9.22 -0.2 0
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217993 85088706 1 OS2N4H18C22 AB2C4D18E22 105.94 1.12 -8.53 -0.79 0
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217994 85088707 1 N6C25H34 A6B25C34 95.95 9.17 -8.47 -0.79 0
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217995 85088711 1 BrO2H19C24 AB2C19D24 -27.56 3.87 -8.66 -0.92 0
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217996 85088712 1 BrO3C22H27 AB3C22D27 -97.9 4.84 -8.86 -0.35 0
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217997 85088714 1 N5O7C18H21 A5B7C18D21 -177.19 4.21 -9.02 -0.94 0
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217998 85088715 1 BNS2O3C21H30 ABC2D3E21F30 -147.79 6.1 -8.54 -0.06 0
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217999 85088716 1 SN3O4H17C22 AB3C4D17E22 -27.28 4.38 -9.06 -0.88 0
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218000 85088719 1 NO5C25H25 AB5C25D25 -132.03 3.05 -9.66 -0.16 0
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218001 85088720 1 O2N5C24H29 A2B5C24D29 -19.02 3.77 -8.96 -0.78 0
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218002 85088721 1 O2N3C26H33 A2B3C26D33 -50.71 4.48 -8.16 0.19 0
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218003 85088723 1 NO2S2C23H33 AB2C2D23E33 -48.11 1.95 -8.8 0.1 0
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218004 85088725 1 TiN2O6C18H36 AB2C6D18E36 -208.19 12.97 -8.8 -2.89 0
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218005 85088726 1 Cl2O2N3C21H23 A2B2C3D21E23 -21.92 3.23 -9.01 -1.06 0
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218006 85088727 1 O3F5C21H25 A3B5C21D25 -354.19 5.01 -10.16 -1.08 0
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218007 85088733 1 O3N4C24H28 A3B4C24D28 -77.98 4.74 -8.55 -0.46 0
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218008 85088734 2 SN2O2C9H10 AB2C2D9E10 -88.65 5.36 -9.23 -0.94 0
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218009 85088735 6 OC4H6 AB4C6 -256.19 7.35 -9.6 -1.88 0
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218010 85088736 3 ON2C7H12 AB2C7D12 -79.08 10.63 -9.45 -0.88 0
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218011 85088742 1 SiO3C26H32 AB3C26D32 -132.27 3.46 -9.16 -0.04 1
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218012 85088743 1 ClO3N8C17H22 AB3C8D17E22 -5.98 1.83 0.0 0.0 0
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218013 85088744 1 GeO2C23H40 AB2C23D40 -114.97 2.79 -8.43 0.44 0
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218014 85088745 1 BrO5C20H21 AB5C20D21 -175.31 2.63 -9.34 -0.83 0
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218015 85088746 1 NF3O4C22H22 AB3C4D22E22 -281.85 5.36 -9.39 -0.49 0
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218016 85088747 1 N3O5C23H23 A3B5C23D23 -177.8 3.25 -9.09 -0.63 0
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218017 85088748 1 NF3O3C23H26 AB3C3D23E26 -247.25 6.33 -8.19 -0.29 0
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218018 85088750 1 SO3N5H19C21 AB3C5D19E21 11.5 7.39 -8.18 -0.87 0
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218019 85088755 1 NSiO4C24H27 ABC4D24E27 -86.94 3.37 -9.03 -1.09 1
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218020 85088757 1 NSO2C26H32 ABC2D26E32 -29.81 2.08 0.0 0.0 0
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218021 85088758 1 NSi2O3C22H39 AB2C3D22E39 -218.59 2.69 -8.44 0.05 0
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218022 85088759 1 ClN5O5C18H20 AB5C5D18E20 -127.71 5.8 -9.07 -0.8 0
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218023 85088760 1 ClO4N5C19H24 AB4C5D19E24 -120.45 2.39 -9.02 -0.75 0
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218024 85088761 1 ClON5C23H24 ABC5D23E24 56.2 4.87 -8.96 -0.96 0
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218025 85088763 1 ClO2S2N3C19H20 AB2C2D3E19F20 26.07 6.3 -8.78 -0.98 0
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218026 85088764 1 O11H18C19 A11B18C19 -366.25 6.63 -9.5 -0.95 0
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218027 85088765 1 P2O7C18H32 A2B7C18D32 -425.2 8.8 -9.22 0.21 0
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218028 85088766 1 SN6O6C16H18 AB6C6D16E18 -155.12 5.36 -9.27 -1.39 0
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218029 85088767 1 FSN4O5C18H19 ABC4D5E18F19 -203.7 6.19 -8.88 -0.61 0
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218030 85088769 1 N2O5C24H26 A2B5C24D26 -160.0 2.75 -8.89 -0.85 0
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218031 85088770 1 SiN2O7C19H26 AB2C7D19E26 -174.33 4.02 -8.98 -2.32 0
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218032 85088771 2 NO3C11H17 AB3C11D17 -306.01 2.69 -9.29 0.41 0
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218033 85088772 1 O2N6C23H30 A2B6C23D30 -23.09 4.19 -9.13 -0.28 0
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218034 85088773 2 O3C12H19 A3B12C19 -267.75 3.07 -8.48 0.27 0
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218035 85088774 1 SN2O2C25H30 AB2C2D25E30 -15.28 6.23 -8.15 -0.2 0
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218036 85088775 1 O5C25H42 A5B25C42 -270.78 4.43 -9.63 -0.33 0
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218037 85088776 1 OC30H46 AB30C46 -7.37 2.95 -8.94 0.6 0
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218038 85088778 1 ClO6C22H27 AB6C22D27 -163.49 8.53 -8.93 -1.54 0
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218039 85088779 1 FN3O8C18H20 AB3C8D18E20 -300.57 7.64 -10.51 -1.48 1
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218040 85088780 1 N5O6C19H30 A5B6C19D30 -231.5 4.82 0.0 0.0 0
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218041 85088781 1 S2N5O5C16H17 A2B5C5D16E17 -110.07 7.51 -8.83 -1.41 0
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218042 85088782 1 O2N3H25C27 A2B3C25D27 19.88 4.29 -8.49 -1.09 0
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218043 85088783 1 NSiO6C21H33 ABC6D21E33 -258.8 3.12 -8.32 -0.3 0
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218044 85088784 1 NO5C24H41 AB5C24D41 -260.91 3.18 -9.85 0.42 0
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218045 85088785 1 ClN5O5C18H22 AB5C5D18E22 -146.53 4.76 -8.98 -0.24 0
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218046 85088786 1 ClNS2O3C20H22 ABC2D3E20F22 -71.92 6.11 -9.25 -1.3 0
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218047 85088788 1 F3N4O4C19H19 A3B4C4D19E19 -266.31 4.56 -9.14 -0.38 0
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218048 85088789 1 F2O2N4C23H26 A2B2C4D23E26 -132.96 6.85 -8.74 -0.75 0
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218049 85088791 2 NO2H10C13 AB2C10D13 -21.5 3.71 -8.9 -1.23 0
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218050 85088793 1 ON2F3H23C25 AB2C3D23E25 -108.35 3.63 -8.92 -0.66 0
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218051 85088794 1 SO3N6C20H24 AB3C6D20E24 -39.39 6.73 -8.62 -0.52 0