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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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391216 135003590 1 N2C19H28 A2B19C28 8.84 2.48 -7.78 0.48 0
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391217 135003593 1 NC19H23 AB19C23 28.59 1.03 -8.66 0.34 0
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391218 135003594 1 FNO6C24H24 ABC6D24E24 -220.3 4.31 -8.75 -0.1 0
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391219 135003613 1 FNSH12C18 ABCD12E18 36.93 1.16 -7.69 -0.52 0
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391220 135003615 1 ON2F4H18C25 AB2C4D18E25 -101.88 7.33 -9.54 -1.66 0
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391221 135003616 2 NOF2H8C12 ABC2D8E12 -121.66 6.76 -9.7 -1.75 0
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391222 135003629 1 NO2C13H15 AB2C13D15 -53.39 1.95 -8.89 0.02 0
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391223 135003631 1 NO3C20H25 AB3C20D25 -105.23 4.77 -8.39 -0.08 0
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391224 135003632 1 NO4C17H23 AB4C17D23 -137.65 4.46 -9.4 -0.74 0
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391225 135003636 2 NO2C7H7 AB2C7D7 -36.14 2.23 -8.78 -0.61 -1
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391226 135003659 1 BNO2F3C16H24 ABC2D3E16F24 -321.26 14.29 0.0 0.0 0
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391227 135003662 1 O2H17C24 A2B17C24 69.94 2.75 0.0 0.0 2
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391228 135003664 2 OH17C23 AB17C23 228.12 4.61 -7.66 -0.82 0
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391229 135003665 1 N4O4C17H26 A4B4C17D26 -135.19 9.69 -9.95 -1.01 0
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391230 135003687 2 NOH11C14 ABC11D14 82.6 6.28 -9.65 -1.17 0
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391231 135003689 1 ClN3O5H12C14 AB3C5D12E14 -89.26 1.22 -9.63 -1.12 0
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391232 135003696 1 OC15H20 AB15C20 -28.64 3.2 -9.65 -0.42 0
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391233 135003702 1 ClO2C14H17 AB2C14D17 -49.86 1.37 -8.74 0.3 0
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391234 135003703 1 NSO2C15H29 ABC2D15E29 -78.35 7.38 -7.87 0.76 0
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391235 135003726 1 ISSeH13C15 ABCD13E15 84.28 1.12 -8.36 -1.42 0
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391236 135003758 1 N2O3C27H28 A2B3C27D28 -47.77 2.97 -8.38 -0.78 0
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391237 135003759 1 N2O3H18C19 A2B3C18D19 -43.18 4.23 -9.49 -0.3 0
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391238 135003798 1 SCl2N2O6H24C29 AB2C2D6E24F29 -128.53 7.92 -8.55 -1.29 0
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391239 135003801 1 NO4H25C55 AB4C25D55 599.82 8.08 -8.02 -2.43 0
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391240 135003803 1 BrNSO2H24C26 ABCD2E24F26 -24.75 1.74 -8.76 -1.1 0
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391241 135003806 1 ClN2O4C17H19 AB2C4D17E19 -156.6 7.27 -9.23 -0.24 0
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391242 135003817 1 N2O5C24H34 A2B5C24D34 -212.65 5.07 -8.83 -0.19 0
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391243 135003837 1 BrSF2O3H11C15 ABC2D3E11F15 -152.38 7.52 -9.32 -0.98 0
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391244 135003847 1 O4N6H20C23 A4B6C20D23 10.08 11.05 -8.85 -1.37 0
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391245 135003852 1 O2N3C24H29 A2B3C24D29 -51.55 2.25 -8.88 0.05 0
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391246 135003854 2 NO2C13H15 AB2C13D15 -122.3 4.62 -8.05 -0.35 0
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391247 135003861 1 NO3C18H23 AB3C18D23 -120.47 3.09 -9.86 -0.64 0
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391248 135003862 1 NSiO2C26H35 ABC2D26E35 -93.48 2.03 -8.71 -0.05 0
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391249 135003864 1 N3O5C23H25 A3B5C23D25 -77.01 5.85 -9.7 -1.56 0
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391250 135003865 1 ClSN2O2H19C26 ABC2D2E19F26 35.3 5.18 -8.65 -0.68 0
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391251 135003867 1 NO6C12H15 AB6C12D15 -215.53 2.79 -10.99 -0.5 0
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391252 135003893 1 OS2C25H50 AB2C25D50 -161.0 0.64 -8.94 -0.42 0
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391253 135003899 1 O3C16H32 A3B16C32 -201.69 2.51 -10.51 0.5 0
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391254 135003901 2 NO2H6C8 AB2C6D8 -112.48 3.01 -9.36 -1.19 0
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391255 135003908 1 NWO3C17H23 ABC3D17E23 119.87 3.79 -6.46 0.28 0
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391256 135003928 1 NSF6C21H23 ABC6D21E23 -320.42 4.38 -8.76 -0.61 0
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391257 135003931 1 ClS3H21C34 AB3C21D34 201.7 3.31 -8.23 -1.18 0
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391258 135003936 1 ClOC13H15 ABC13D15 -8.31 1.76 -9.15 0.28 0
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391259 135003937 1 NO2S2C15H23 AB2C2D15E23 -29.37 4.74 -8.18 0.02 0
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391260 135003940 1 BrOF3H10C12 ABC3D10E12 -143.12 2.9 -8.93 -1.03 0
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391261 135003964 1 NPO5C15H24 ABC5D15E24 -261.01 4.0 -9.03 0.12 0
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391262 135003967 1 N2O3C17H22 A2B3C17D22 -132.49 2.51 -8.54 -0.1 0
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391263 135003987 1 BrNO2C26H26 ABC2D26E26 -0.52 3.55 -9.13 -0.63 0
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391264 135003994 1 FN2O2H25C26 AB2C2D25E26 -39.56 4.75 -8.39 -0.16 0
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391265 135003998 1 NO5C18H25 AB5C18D25 -182.54 4.98 -9.2 0.34 0
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391266 135004008 1 NO4H25C30 AB4C25D30 -42.21 5.85 -8.98 -0.86 0
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391267 135004014 1 N3O3C14H23 A3B3C14D23 -144.57 4.06 -9.05 -0.37 0
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391268 135004025 1 N2O5C26H38 A2B5C26D38 -214.38 5.35 -8.95 -0.73 0
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391269 135004026 1 O4N5H19C23 A4B5C19D23 20.97 2.9 -9.53 -2.18 0
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391270 135004029 1 N2O7C29H30 A2B7C29D30 -235.5 2.03 -9.28 -0.37 0
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391271 135004041 1 N4O6C25H26 A4B6C25D26 -102.55 7.98 -8.74 -1.46 0
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391272 135004053 1 N3O5C25H27 A3B5C25D27 -132.24 3.06 -8.59 -1.12 0
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391273 135004055 1 SN2O4C18H20 AB2C4D18E20 -141.85 2.87 -8.68 -0.4 0
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391274 135004059 1 ClNO6C16H22 ABC6D16E22 -260.48 5.27 -9.41 -0.17 0
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391275 135004061 2 N2O4C11H12 A2B4C11D12 -233.26 4.0 -8.73 -0.64 0
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391276 135004062 1 NO5C23H29 AB5C23D29 -193.61 5.9 -8.49 -0.39 0
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391277 135004064 1 O2N3C21H25 A2B3C21D25 -36.88 3.43 -9.11 -0.23 0
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391278 135004080 1 O4F5Cl7C15H16 A4B5C7D15E16 -516.99 6.6 -10.51 -0.69 0
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391279 135004081 1 BrSF2O3H11C15 ABC2D3E11F15 -152.18 8.59 -9.42 -0.94 0
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391280 135004085 1 NSiO5C18H27 ABC5D18E27 -163.37 4.14 -9.09 -0.62 0
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391281 135004086 1 NO5C19H21 AB5C19D21 -100.27 5.09 -9.15 -0.71 0
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391282 135004090 1 NOH17C18 ABC17D18 4.38 1.78 -8.56 -0.37 0
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391283 135004113 1 SN2O4H22C25 AB2C4D22E25 -54.92 5.81 -9.89 -0.55 0
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391284 135004114 1 NSeO4C16H19 ABC4D16E19 29.57 6.28 -9.14 -3.03 0
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391285 135004119 1 FNO2H10C12 ABC2D10E12 -89.52 3.68 -10.03 -1.44 0
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391286 135004121 1 N2O5H12C15 A2B5C12D15 -5.43 7.93 -9.96 -1.91 0
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391287 135004129 1 BrOH17C18 ABC17D18 16.42 2.76 -9.56 -0.79 0
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391288 135004153 1 CrO6C34H40 AB6C34D40 30.01 2.88 -6.32 0.33 0
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391289 135004154 1 CrOC29H40 ABC29D40 24.36 0.45 -7.35 0.51 0
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391290 135004161 1 CrN2O7C29H30 AB2C7D29E30 -135.93 1.67 -8.37 -0.15 0