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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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382093 134973022 2 O8C23H30 A8B23C30 -637.66 7.22 -9.02 0.06 0
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382094 134973023 1 SiO2C13H24 AB2C13D24 -95.16 1.15 -8.84 0.76 0
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382095 134973026 1 NO5C23H25 AB5C23D25 -182.0 2.31 -9.62 -0.72 0
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382096 134973027 1 NO5C24H27 AB5C24D27 -190.14 2.02 -9.73 -0.65 0
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382097 134973028 1 NPtH11C12 ABC11D12 234.75 7.58 -8.03 -3.06 0
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382098 134973029 1 BrO4C18H23 AB4C18D23 -115.41 2.39 -8.43 -0.02 0
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382099 134973031 2 O4C8H11 A4B8C11 -323.2 4.47 -8.69 -0.25 0
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382100 134973035 1 BrSO3C16H23 ABC3D16E23 -73.21 3.92 -8.94 -1.06 0
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382101 134973036 1 N3O4H17C20 A3B4C17D20 -71.4 1.63 -9.9 -1.46 0
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382102 134973037 1 O4C17H18 A4B17C18 -69.93 3.17 -8.7 -0.01 0
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382103 134973038 1 BrSO3C17H19 ABC3D17E19 -23.91 3.49 -9.16 -1.19 0
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382104 134973039 1 SO3C17H18 AB3C17D18 -14.23 3.09 -8.83 -0.82 0
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382105 134973040 1 NSO2H13C19 ABC2D13E19 -6.88 7.75 -8.94 -1.41 0
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382107 134973044 1 NO3C16H19 AB3C16D19 -2.9 7.51 -9.08 -1.34 0
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382108 134973045 1 NO3H17C19 AB3C17D19 38.36 6.04 -9.23 -1.42 0
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382109 134973048 1 SiO5C17H32 AB5C17D32 -264.89 2.69 -8.9 0.04 0
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382110 134973050 1 N3O10C17H29 A3B10C17D29 -367.77 7.08 -10.07 -0.66 0
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382111 134973053 1 N3O12C19H27 A3B12C19D27 -471.96 2.23 -10.02 -0.18 0
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382112 134973054 1 NO9C16H27 AB9C16D27 -418.31 4.54 -9.82 -0.2 0
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382113 134973055 1 NO8C12H21 AB8C12D21 -382.08 8.83 -10.18 -0.16 0
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382114 134973056 2 N2O4C8H13 A2B4C8D13 -295.25 1.91 -9.9 -0.23 0
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382115 134973057 1 INO8C16H26 ABC8D16E26 -352.21 3.04 -9.8 -1.25 0
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382116 134973060 1 ON3H21C24 AB3C21D24 77.05 4.22 -9.05 -0.62 -1
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382118 134973062 1 ClNO3C19H24 ABC3D19E24 -103.67 1.22 -8.83 0.02 0
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382119 134973063 1 NO3C19H23 AB3C19D23 -51.91 1.46 -9.38 -0.08 0
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382120 134973064 1 NO3C19H23 AB3C19D23 -82.91 1.42 -9.16 0.1 0
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382121 134973068 1 N3O5C27H29 A3B5C27D29 -71.17 3.75 -9.48 -0.23 0
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382122 134973070 1 BrO2N6C12H15 AB2C6D12E15 -10.89 12.02 -8.74 -0.51 0
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382123 134973071 1 BrO2N6H13C15 AB2C6D13E15 27.37 5.6 -8.84 -0.77 0
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382124 134973072 1 O6C23H28 A6B23C28 -241.41 3.83 -8.91 -0.76 0
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382125 134973073 1 O6C23H28 A6B23C28 -235.9 5.1 -8.84 -0.65 0
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382126 134973074 1 O9C16H24 A9B16C24 -416.71 2.57 -10.44 0.23 0
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382127 134973075 1 O5C14H22 A5B14C22 -252.18 3.74 -10.21 0.25 0
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382128 134973078 1 SiC15H24 AB15C24 -14.45 1.13 -9.06 1.32 0
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382129 134973079 2 O2N3C28H30 A2B3C28D30 1.97 4.08 -8.67 -0.8 0
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382130 134973080 1 OH18C25 AB18C25 63.67 0.46 -8.62 -0.45 0
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382131 134973081 1 SN3O9C21H33 AB3C9D21E33 -420.54 9.22 -8.58 0.06 0
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382132 134973082 1 SN3C27H27 AB3C27D27 93.09 5.85 -8.56 -0.6 1
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382133 134973083 1 ON2C34H35 AB2C34D35 53.48 2.65 0.0 0.0 0
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382134 134973084 1 NO3C17H19 AB3C17D19 -2.76 6.56 -9.06 -1.36 0
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382135 134973085 1 SN2O2C16H16 AB2C2D16E16 -50.2 1.57 -8.72 -0.62 0
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382136 134973089 1 NO2C21H38 AB2C21D38 -74.36 3.05 0.0 0.0 0
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382137 134973092 1 NO6C35H41 AB6C35D41 -184.67 6.18 -9.15 -0.27 0
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382138 134973093 1 NSO2H11C15 ABC2D11E15 -39.67 4.43 -8.7 -1.26 0
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382139 134973094 1 NSO3H19C20 ABC3D19E20 -47.7 5.21 -9.04 -0.71 0
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382140 134973096 2 SiO2C13H24 AB2C13D24 -316.59 0.72 -8.72 -0.57 0
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382141 134973097 1 IPO6C21H28 ABC6D21E28 -281.76 3.45 -8.75 -0.59 1
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382142 134973099 1 NC9H12 AB9C12 61.09 2.29 0.0 0.0 0
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382143 134973100 1 NO3C35H35 AB3C35D35 3.9 6.23 -8.28 -1.04 0
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382144 134973101 1 SiO2C16H32 AB2C16D32 -175.99 2.37 -8.78 0.74 0
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382145 134973104 1 SO2N4C24H24 AB2C4D24E24 35.25 3.84 -8.61 -0.56 0
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382146 134973105 2 ON2H11C12 AB2C11D12 5.16 4.53 -8.54 -1.07 0
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382147 134973107 1 BrO2N6C19H21 AB2C6D19E21 8.67 11.9 -8.56 -0.72 0
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382148 134973110 1 N5C21H21 A5B21C21 138.79 1.54 -8.05 -0.34 0
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382149 134973111 1 NO6C27H35 AB6C27D35 -242.17 3.05 -8.98 -0.61 0
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382150 134973113 1 SSiN2O7C19H30 ABC2D7E19F30 -308.94 8.77 -9.04 -0.39 0
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382151 134973114 1 O5H18C23 A5B18C23 -115.32 2.73 -8.68 -0.9 0
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382152 134973115 1 O7C15H22 A7B15C22 -309.89 4.38 -10.09 0.44 0
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382153 134973117 2 O4C9H14 A4B9C14 -376.58 1.43 -10.27 -0.07 0
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382154 134973118 1 SO3C20H22 AB3C20D22 -36.51 6.18 -10.06 -0.6 0
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382155 134973125 2 SN3O3C16H24 AB3C3D16E24 -225.86 8.99 -8.87 -1.37 0
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382157 134973127 1 C25H34 A25B34 40.5 1.54 -9.07 0.38 0
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382158 134973128 1 O7C13H20 A7B13C20 -347.32 2.69 -10.41 0.54 0
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382159 134973129 1 O5C19H28 A5B19C28 -216.38 1.51 -9.4 0.31 0
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382160 134973130 1 SiO6C29H42 AB6C29D42 -287.83 2.11 -9.29 -0.62 0
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382161 134973131 1 SiO4C24H38 AB4C24D38 -220.66 2.41 -8.86 0.04 0
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382162 134973132 2 SiO2C15H26 AB2C15D26 -288.24 3.36 -8.75 0.04 0
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382163 134973133 1 Si2O5C33H58 A2B5C33D58 -348.15 2.78 -8.82 0.07 0
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382164 134973135 1 SO4C21H40 AB4C21D40 -168.14 1.44 -8.5 0.72 0
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382165 134973137 1 NO2C21H38 AB2C21D38 -73.54 3.57 0.0 0.0 0
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382166 134973139 1 NO3C21H38 AB3C21D38 -152.42 6.37 0.0 0.0 0
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382167 134973140 1 NO2C21H38 AB2C21D38 -93.23 6.68 0.0 0.0 0
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382168 134973141 1 NO3C21H38 AB3C21D38 -151.59 6.15 0.0 0.0 0
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382169 134973142 1 NO3C21H40 AB3C21D40 -178.08 5.69 0.0 0.0 0
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382170 134973144 1 ClO2N8C19H21 AB2C8D19E21 136.82 8.4 -8.82 -1.63 0