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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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388985 134990809 1 ClN2S2C6H7 AB2C2D6E7 40.12 2.99 -8.59 -0.86 0
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388989 134990828 1 ClSN2O5C18H33 ABC2D5E18F33 -270.59 8.12 -9.05 0.0 0
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388991 134990832 1 SO11H26C29 AB11C26D29 -393.46 7.23 -8.78 -1.57 0
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388992 134990841 2 O2C11H15 A2B11C15 -174.26 3.73 -9.82 -0.1 0
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388995 134990846 1 O5C22H28 A5B22C28 -202.88 7.44 -9.82 -0.83 0
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388996 134990848 2 O3C12H16 A3B12C16 -266.93 3.47 -9.91 -0.51 0
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388998 134990854 1 NO14C55H101 AB14C55D101 -781.46 2.58 -8.88 0.29 0
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388999 134990855 1 ON5C13H17 AB5C13D17 41.92 4.43 -10.09 -0.47 0
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389000 134990857 1 NO4C22H27 AB4C22D27 -108.04 6.18 -8.12 -0.23 0
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389001 134990858 1 NF2H17C23 AB2C17D23 21.76 4.2 -8.65 -0.38 0
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389002 134990868 1 O2Br3C20H25 A2B3C20D25 -94.44 2.73 -10.0 -1.14 0
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389003 134990872 1 BrNF3O4H15C16 ABC3D4E15F16 -262.31 6.68 -9.53 -0.96 0
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389004 134990875 1 NaO6C25H31 AB6C25D31 -297.38 6.44 -8.89 -0.21 0
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389005 134990880 1 SN6O8C34H34 AB6C8D34E34 -139.25 5.04 -9.09 -1.15 0
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389006 134990886 1 F2O6C25H40 A2B6C25D40 -421.91 7.18 -9.95 -0.33 0
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389007 134990887 1 NO8C21H29 AB8C21D29 -344.36 3.42 -9.63 0.07 0
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389008 134990896 1 NSiO7C24H41 ABC7D24E41 -374.76 8.02 -8.65 -0.41 0
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389013 134990912 1 O7C26H34 A7B26C34 -288.16 3.14 -9.32 -0.56 0
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389014 134990913 1 SN5O7C25H33 AB5C7D25E33 -255.78 7.45 -9.46 -0.75 0
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389016 134990915 1 IN2O6H13C18 AB2C6D13E18 -47.12 7.86 -9.05 -1.75 0
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389017 134990916 1 INO5H10C14 ABC5D10E14 -31.43 8.61 -9.17 -1.73 0
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389018 134990918 1 SN5O6C22H27 AB5C6D22E27 -161.09 9.15 -9.69 -0.59 0
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389021 134990921 1 BrNO4C20H22 ABC4D20E22 -127.29 3.68 -8.88 -0.96 0
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389022 134990922 1 N2F3O4H21C23 A2B3C4D21E23 -274.04 6.28 -9.07 -1.43 0
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389023 134990924 1 ClFN2O2C19H20 ABC2D2E19F20 -97.21 4.28 -8.91 -0.98 0
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389025 134990926 1 N2O3C21H28 A2B3C21D28 -111.4 1.88 -8.24 0.08 0
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389026 134990927 1 BrO4C22H31 AB4C22D31 -199.93 1.18 -9.49 -0.89 0
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389027 134990928 1 OC19H28 AB19C28 -56.69 1.89 -8.22 0.56 0
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389028 134990930 1 OCl2N3H13C16 AB2C3D13E16 83.89 4.53 -9.24 -1.43 0
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389029 134990931 1 BrNSH18C19 ABCD18E19 69.79 1.35 -8.65 -0.77 0
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389030 134990933 1 NO2S2H13C15 AB2C2D13E15 -16.84 5.59 -8.38 -0.75 0
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389031 134990937 1 O5C31H48 A5B31C48 -295.48 6.6 -9.77 0.03 0
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389032 134990938 1 SO6C21H22 AB6C21D22 -200.52 4.83 -9.16 -0.18 0
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389033 134990939 1 NO3C9H11 AB3C9D11 -78.49 4.53 -8.98 -0.59 0
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389034 134990940 1 HgNSO2C5H9 ABCD2E5F9 -44.05 4.96 -9.35 -2.49 0
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389035 134990943 1 NO3C22H27 AB3C22D27 -83.55 4.86 -8.63 0.19 0
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389036 134990944 1 NO2C22H27 AB2C22D27 -60.37 3.38 -8.5 0.32 0
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389037 134990954 1 S5N7Na7O42C81H84 A5B7C7D42E81F84 -1998.82 46.39 -8.53 -1.27 0
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389038 134990964 1 N2O4C21H22 A2B4C21D22 -102.58 2.14 -8.88 -0.34 0
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389039 134990966 1 BrNOSC19H20 ABCDE19F20 21.95 4.21 -8.72 -0.8 0
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389040 134990970 2 OC10H16 AB10C16 -139.98 3.29 -9.6 1.02 0
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389041 134990971 1 S2N11O12C64H87 A2B11C12D64E87 -488.68 4.18 -8.78 -0.29 0
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389043 134990979 1 BrSN3C15H20 ABC3D15E20 45.03 4.8 -8.41 -0.64 0
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389044 134990981 1 PN5O5C22H30 AB5C5D22E30 -203.48 6.85 -9.31 -0.82 0
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389048 134990989 1 FN3O4C41H44 AB3C4D41E44 -156.86 4.37 -8.59 -0.4 0
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389049 134990990 1 NSO4C15H21 ABC4D15E21 -132.1 6.34 -8.85 -0.41 0
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389050 134990991 1 SO4C7H10 AB4C7D10 -146.06 6.31 -10.32 -0.21 0
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389051 134990994 1 NO6F9H10C12 AB6C9D10E12 -712.61 1.98 -11.32 -1.21 0
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389052 134990996 1 O7C26H34 A7B26C34 -335.73 4.57 -10.05 -0.37 0
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389053 134991002 1 N5O5C16H27 A5B5C16D27 -217.75 5.39 -9.28 -1.29 0
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389054 134991003 1 NOC21H31 ABC21D31 -10.28 1.69 -8.71 0.38 0
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389055 134991010 1 NI2O5H13C16 AB2C5D13E16 -119.23 6.6 -8.79 -1.27 0
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389056 134991013 1 NO5C25H33 AB5C25D33 -225.66 2.9 -9.49 0.13 0
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389058 134991023 2 N2O4H8C9 A2B4C8D9 -112.56 2.75 -9.36 -2.01 0
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389059 134991025 1 FN3O3C21H26 AB3C3D21E26 -125.06 6.6 -8.67 -0.59 0
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389060 134991027 1 NO4C18H27 AB4C18D27 -185.26 3.7 -8.72 0.15 0
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389061 134991028 2 OC11H17 AB11C17 -120.62 1.84 -8.53 1.51 0
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389064 134991053 1 ClN2O2C17H25 AB2C2D17E25 -82.03 3.02 -8.52 0.63 0
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389066 134991056 1 BNC10H23 ABC10D23 38.49 5.74 0.0 0.0 0
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389068 134991068 1 OC15H24 AB15C24 -48.48 3.71 -9.1 0.6 0
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389069 134991070 1 OC10H16 AB10C16 -49.46 3.02 -9.73 0.76 0
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389070 134991071 1 OC13H20 AB13C20 -70.85 3.63 -8.96 0.85 0
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389071 134991072 1 SiF2H12C14 AB2C12D14 -134.01 2.65 -9.27 -0.59 0
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389072 134991075 1 S2C11H20 A2B11C20 -19.81 2.47 -8.49 0.44 0
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389073 134991076 1 ClOC9H13 ABC9D13 -55.23 3.79 -9.56 0.26 0
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389074 134991077 1 SiO2C11H20 AB2C11D20 -132.35 5.09 -9.25 0.88 -1
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389075 134991078 1 FeNPdSiF3O3C25H35 ABCDE3F3G25H35 -73.15 2.66 0.0 0.0 0
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389076 134991079 1 AlC33H63 AB33C63 -155.61 0.2 -9.23 2.39 0
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389077 134991080 1 NiN2O2C17H22 AB2C2D17E22 115.81 9.54 -7.82 -3.93 0
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389079 134991083 1 Zn4N6O13C30H66 A4B6C13D30E66 -581.29 11.14 -5.75 -2.34 2
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389080 134991086 1 PdK2N2O8H20C24 AB2C2D8E20F24 -357.64 11.04 -6.47 -0.51 0
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389081 134991088 1 BrON2C37H37 ABC2D37E37 100.68 11.01 -7.29 -1.44 0
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389082 134991090 1 FeON2P2C43H46 ABC2D2E43F46 191.41 4.19 -7.27 -1.05 0
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389083 134991102 1 ClON2H33C34 ABC2D33E34 67.18 9.89 -8.22 -1.44 0
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389084 134991109 1 SN2O5C18H28 AB2C5D18E28 -90.06 3.83 -8.84 -1.08 0
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389085 134991116 1 BNNaC4H10 ABCD4E10 41.55 3.77 0.0 0.0 0
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389086 134991117 1 ON2C15H24 AB2C15D24 -21.78 1.64 -8.44 0.06 0
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389087 134991118 1 NO2C22H27 AB2C22D27 -25.65 2.88 -8.34 0.02 0
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389088 134991119 2 NSO3C13H23 ABC3D13E23 -319.77 3.34 -9.37 0.54 0
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389089 134991120 1 P2C49H52 A2B49C52 56.42 3.47 -7.91 0.45 0
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389090 134991121 1 NSF3O3C18H20 ABC3D3E18F20 -240.88 13.54 -9.12 -1.1 1
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389091 134991122 1 NC17H20 AB17C20 41.36 2.26 0.0 0.0 0
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389092 134991125 1 NO4C25H33 AB4C25D33 -137.97 3.63 -9.11 0.15 0
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389093 134991129 1 CuN2S2F6O6H32C38 AB2C2D6E6F32G38 -308.74 15.36 0.0 0.0 0
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389094 134991132 1 N2Zr2O9C22H56 A2B2C9D22E56 -1004.8 8.05 -8.66 0.58 0
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389095 134991133 1 N2Zr2O9C22H56 A2B2C9D22E56 -792.52 9.6 -7.4 -0.97 0
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389097 134991138 2 BCl2 AB2 -112.28 0.03 -10.16 -1.49 0
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389098 134991139 1 ClN3H4O5C6 AB3C4D5E6 27.27 5.2 -10.63 -2.33 0
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389101 134991149 1 N2Zn2O3C45H51 A2B2C3D45E51 40.16 5.29 0.0 0.0 0
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389102 134991154 2 C7H13 A7B13 -46.07 0.15 -9.39 1.48 0
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389104 134991166 1 NC5O5H9 AB5C5D9 -220.59 6.14 -9.4 -0.22 0
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389105 134991167 1 TiCl2C30H34 AB2C30D34 44.24 15.41 -5.79 -2.47 0
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389106 134991168 2 C15H17 A15B17 138.79 1.78 -5.76 -3.51 -1
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389107 134991169 1 PS3O7H14C18 AB3C7D14E18 -100.23 28.05 0.0 0.0 1
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389108 134991173 1 CuC3O3 AB3C3 15.5 0.12 0.0 0.0 0
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389109 134991181 1 NO3C28H29 AB3C28D29 -49.99 1.24 -8.65 -0.77 0
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389110 134991184 1 Co2O4H12C15 A2B4C12D15 -120.35 14.4 -9.8 -6.15 0
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389111 134991188 1 RuN2O3H46C61 AB2C3D46E61 377.32 3.7 -7.72 -2.6 0
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389112 134991190 1 BSBr2C12H23 ABC2D12E23 -63.8 4.38 -8.26 -1.6 0
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389113 134991197 3 FOH3C4 ABC3D4 -241.37 3.91 -10.69 -1.34 0