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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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393025 135018995 1 LiN2C20H25 AB2C20D25 70.06 14.66 -5.7 -0.03 0
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393026 135019002 1 N5O6C20H23 A5B6C20D23 -214.14 11.99 -8.81 -0.34 0
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393027 135019003 1 LiSO2Si2C15H27 ABC2D2E15F27 -153.92 5.94 -7.07 0.17 0
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393029 135019006 1 NF3O11C37H40 AB3C11D37E40 -539.51 5.65 -8.78 -0.69 0
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393030 135019019 1 ClO7H21C22 AB7C21D22 -227.12 4.05 -8.77 -0.92 0
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393031 135019020 1 O7C22H22 A7B22C22 -218.61 2.63 -8.63 -0.78 0
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393033 135019037 1 OC17H19 AB17C19 30.91 2.66 0.0 0.0 0
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393034 135019041 1 SiO3C19H28 AB3C19D28 -151.96 2.07 -8.9 -0.74 0
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393035 135019048 1 NO5C19H25 AB5C19D25 -220.25 0.76 -9.89 -0.98 0
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393036 135019049 1 ClON2C19H19 ABC2D19E19 1.32 4.43 -8.73 -0.62 0
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393037 135019050 1 CoNC4H6 ABC4D6 68.89 5.02 -9.41 -5.0 0
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393038 135019059 1 BrClSN2O2H24C30 ABCD2E2F24G30 19.96 7.48 -8.62 -0.54 0
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393039 135019084 1 N2O5C23H24 A2B5C23D24 -160.42 3.25 -8.92 -0.47 0
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393040 135019085 1 O3N5C18H19 A3B5C18D19 -60.63 6.87 -9.18 -1.11 0
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393041 135019096 1 OC13H22 AB13C22 -63.74 1.85 -8.93 1.68 0
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393042 135019098 1 NO8C22H31 AB8C22D31 -332.09 4.07 -8.31 -0.04 0
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393043 135019100 1 NO6C15H23 AB6C15D23 -259.24 4.29 -9.9 -0.02 0
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393044 135019102 1 N2O4C17H20 A2B4C17D20 -125.25 6.15 -9.87 -0.22 0
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393045 135019104 2 NC9H9 AB9C9 71.72 2.92 -8.43 0.11 0
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393046 135019105 1 NH25C30 AB25C30 113.96 2.94 -8.29 0.08 0
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393047 135019141 1 BrNOH16C18 ABCD16E18 39.07 2.12 -8.56 -0.27 1
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393048 135019142 1 SN2O2H19C22 AB2C2D19E22 63.3 7.06 0.0 0.0 0
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393049 135019147 1 NO7H27C29 AB7C27D29 -215.91 1.56 -9.63 -0.25 0
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393050 135019148 1 NO8C35H37 AB8C35D37 -282.94 4.31 -9.56 -0.49 0
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393051 135019155 1 O4H26C31 A4B26C31 -75.78 2.69 -9.1 -0.15 0
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393052 135019156 1 O4C29H30 A4B29C30 -122.8 3.14 -9.07 -0.17 0
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393055 135019169 1 FSN2O2H13C19 ABC2D2E13F19 59.1 5.96 -8.82 -1.3 0
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393056 135019171 4 OC4H4 AB4C4 -127.99 1.59 -9.51 -0.53 0
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393057 135019172 1 BrOSC10H17 ABCD10E17 -67.4 1.82 -9.28 -0.47 0
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393058 135019174 1 ClO5C9H19 AB5C9D19 -253.72 2.74 -10.25 0.42 0
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393059 135019176 1 NO3H23C28 AB3C23D28 -20.29 2.93 -8.35 -0.83 0
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393060 135019177 1 ON2H22C28 AB2C22D28 57.87 4.23 -8.46 -0.66 0
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393061 135019178 1 ON2H20C28 AB2C20D28 70.67 3.77 -8.47 -0.93 1
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393062 135019179 1 NSO2H14C16 ABC2D14E16 81.81 4.58 0.0 0.0 0
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393063 135019180 1 ClBr3O4H18C22 AB3C4D18E22 -99.21 2.24 -8.69 -1.11 0
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393064 135019181 1 NCl3O3C23H24 AB3C3D23E24 -123.45 2.02 -9.54 -0.55 0
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393065 135019182 1 N2O2C5H12 A2B2C5D12 -81.55 3.55 -9.37 1.91 0
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393066 135019183 1 O4C27H34 A4B27C34 -101.97 5.25 -8.71 0.03 0
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393067 135019184 1 O4C29H30 A4B29C30 -44.2 4.44 -8.58 -0.87 0
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393068 135019185 1 O4C29H36 A4B29C36 -94.04 3.08 -8.59 0.1 0
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393069 135019194 1 ClO4H17C19 AB4C17D19 -121.4 1.92 -9.28 -1.14 0
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393070 135019197 1 N2O3H28C30 A2B3C28D30 -57.23 4.94 -7.91 -0.82 0
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393071 135019204 1 O2C13H16 A2B13C16 -34.39 3.92 -9.65 0.09 0
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393072 135019231 1 O3C21H28 A3B21C28 -120.52 5.28 -9.4 0.11 0
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393073 135019233 1 SO3C28H38 AB3C28D38 -116.78 2.23 -8.76 -0.23 0
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393074 135019244 1 O4C29H30 A4B29C30 -124.36 3.09 -8.86 -0.15 0
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393075 135019290 1 NOC14H17 ABC14D17 -0.66 1.99 -9.87 -0.13 0
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393076 135019295 1 O3C11H20 A3B11C20 -152.53 4.48 -10.18 -0.32 0
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393077 135019296 1 N7H19C25 A7B19C25 223.59 4.41 -8.72 -1.13 0
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393078 135019297 1 NO3C18H19 AB3C18D19 -21.25 3.96 -9.5 0.07 0
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393079 135019301 1 NO4H13C15 AB4C13D15 -37.19 5.76 -9.74 -0.82 0
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393080 135019302 1 OF2N2H14C15 AB2C2D14E15 -87.8 4.71 -8.96 -0.77 0
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393081 135019303 1 FON2C17H19 ABC2D17E19 -63.79 1.56 -8.51 -0.25 0
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393082 135019307 1 SN2O3H30C32 AB2C3D30E32 24.0 5.8 -8.71 -0.16 0
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393083 135019309 1 SN2H22C25 AB2C22D25 107.62 3.28 -8.76 -0.05 0
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393084 135019310 1 SN2O2H26C27 AB2C2D26E27 31.3 3.38 -8.44 -0.1 0
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393085 135019311 1 PN2O3C17H23 AB2C3D17E23 -85.81 4.23 -7.63 0.21 1
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393086 135019317 1 ON7H22C24 AB7C22D24 159.31 8.13 0.0 0.0 0
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393087 135019318 1 NO5C17H27 AB5C17D27 -197.69 7.05 -8.72 -0.25 0
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393088 135019321 1 BrSO2N3H14C15 ABC2D3E14F15 2.15 3.55 -8.98 -0.99 0
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393089 135019322 1 Si2O3C30H42 A2B3C30D42 -140.79 1.99 -9.12 -0.12 0
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393092 135019325 1 SiO5C36H52 AB5C36D52 -221.85 4.93 -8.82 0.29 0
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393093 135019326 1 BrO3N6H27C33 AB3C6D27E33 65.19 13.72 -8.09 -1.37 0
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393094 135019327 1 Cl2N2O3C15H17 A2B2C3D15E17 -116.39 3.36 0.0 0.0 0
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393095 135019328 1 Cl2N2O3C15H17 A2B2C3D15E17 -46.51 4.84 0.0 0.0 1
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393096 135019329 1 ClN2O3C15H18 AB2C3D15E18 -109.53 0.82 0.0 0.0 0
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393097 135019332 1 ClN2O3C15H16 AB2C3D15E16 -89.91 4.45 0.0 0.0 0
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393098 135019333 1 ClN2O3C15H16 AB2C3D15E16 -2.99 3.37 0.0 0.0 0
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393099 135019342 1 NO2H19C20 AB2C19D20 -28.39 3.56 -8.65 -0.53 0
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393100 135019345 1 NSO4H29C33 ABC4D29E33 -68.52 5.26 -8.85 -0.66 0
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393101 135019375 1 F3N3O4C16H16 A3B3C4D16E16 -269.3 5.74 -8.93 -0.58 0
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393102 135019380 1 NNaO2H20C43 ABC2D20E43 292.84 23.84 -7.31 -2.35 0
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393103 135019381 1 NO2H21C43 AB2C21D43 279.89 8.37 -8.64 -1.8 0
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393104 135019382 1 NO10C15H27 AB10C15D27 -446.51 4.85 -10.12 -0.02 0
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393105 135019383 1 NO6H21C45 AB6C21D45 155.01 14.08 -8.62 -1.8 0