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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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359238 127297735 1 SO2N3C14H23 AB2C3D14E23 -77.5 3.67 -9.22 -0.5 0
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359239 127297736 1 N2O3C18H26 A2B3C18D26 -130.06 2.32 -8.76 0.2 0
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359240 127297757 1 ClO2N4C20H23 AB2C4D20E23 -41.86 1.22 -8.71 -0.39 0
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359241 127297758 1 N3O3C18H25 A3B3C18D25 -127.04 2.03 -8.99 -0.02 0
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359242 127297759 1 N3O3C22H27 A3B3C22D27 -82.66 2.33 -8.35 0.0 0
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359243 127297760 1 N2O3C22H26 A2B3C22D26 -92.16 6.7 -8.53 -0.1 0
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359244 127297761 1 N2O3C24H28 A2B3C24D28 -98.83 5.69 -8.58 -0.6 0
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359245 127297762 1 SN3O3C21H25 AB3C3D21E25 -87.27 2.47 -8.79 -0.68 0
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359246 127297763 1 ClN2O3C21H23 AB2C3D21E23 -94.64 1.35 -8.95 -0.34 0
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359247 127297764 1 N2O3C22H26 A2B3C22D26 -88.64 3.22 -8.82 0.11 0
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359248 127297765 1 N2O3C22H32 A2B3C22D32 -134.76 5.39 -8.71 0.26 0
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359249 127297766 2 NO2C11H12 AB2C11D12 -111.16 2.16 -8.65 0.02 0
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359250 127297774 1 N2O3C22H26 A2B3C22D26 -92.07 3.65 -8.73 0.02 0
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359251 127297775 1 N2O3C22H26 A2B3C22D26 -89.87 5.72 -8.73 -0.11 0
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359252 127297776 1 FO2N4C22H23 AB2C4D22E23 -55.28 3.8 -8.9 -0.81 0
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359253 127297777 1 O2N4C23H26 A2B4C23D26 -30.16 3.22 -8.82 -0.28 0
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359254 127297778 1 N2O3C22H26 A2B3C22D26 -92.28 3.77 -8.65 -0.06 0
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359255 127297779 1 N2O3C21H24 A2B3C21D24 -84.45 1.46 -8.9 0.05 0
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359256 127297780 1 ClN2O3C21H23 AB2C3D21E23 -92.72 4.64 -8.64 -0.43 0
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359257 127297781 1 FN2O3C21H23 AB2C3D21E23 -132.49 2.34 -8.95 -0.26 0
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359258 127297782 1 F2N2O3C21H22 A2B2C3D21E22 -176.22 2.75 -8.99 -0.5 0
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359259 127297783 1 SN2O3C12H22 AB2C3D12E22 -156.96 6.11 -10.01 0.62 0
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359260 127297784 2 ON2C10H18 AB2C10D18 -124.94 3.67 -8.79 0.94 0
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359261 127297785 1 N2O2C13H24 A2B2C13D24 -118.87 3.55 -9.22 1.08 0
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359262 127297786 1 O2N4C15H28 A2B4C15D28 -110.68 6.52 -9.01 0.71 0
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359263 127297797 1 ClN3O3C18H24 AB3C3D18E24 -125.29 4.1 -8.98 -0.3 0
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359264 127297798 1 ClO2N4C20H21 AB2C4D20E21 -39.52 4.0 -8.95 -0.3 0
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359265 127297799 1 ClN3O3C18H24 AB3C3D18E24 -127.8 7.0 -9.39 -0.23 0
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359266 127297800 1 ClO2N3C17H20 AB2C3D17E20 -66.19 4.63 -8.96 -0.26 0
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359267 127297801 1 N3O4C22H29 A3B4C22D29 -154.85 7.63 -9.24 -0.26 0
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359268 127297802 1 SO2N5C18H25 AB2C5D18E25 -49.42 7.78 -8.46 -1.53 0
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359269 127297803 1 O2N3C23H31 A2B3C23D31 -71.63 4.17 -9.24 -0.09 0
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359270 127297866 1 FSN3O4C18H26 ABC3D4E18F26 -207.92 9.68 -9.17 -0.88 0
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359271 127297867 1 N3O3C23H29 A3B3C23D29 -94.29 1.16 -8.9 -0.02 0
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359272 127297868 1 SO2N4C17H22 AB2C4D17E22 -39.56 2.32 -8.72 -0.96 0
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359273 127297869 1 O2N3C20H31 A2B3C20D31 -93.17 4.57 -8.62 0.19 0
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359274 127297870 1 ClN3O4C16H20 AB3C4D16E20 -154.06 4.48 -9.06 -0.42 0
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359275 127297871 1 O2N4C19H34 A2B4C19D34 -104.17 4.59 -8.77 0.86 0
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359276 127297872 2 ON2C7H13 AB2C7D13 -109.47 4.84 -8.95 0.77 0
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359277 127297873 1 O2N4C19H24 A2B4C19D24 -44.65 4.25 -8.91 -0.52 0
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359278 127297874 1 SO2N3C22H27 AB2C3D22E27 -49.88 1.74 -8.49 -0.06 0
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359279 127297876 1 O2N6C13H16 A2B6C13D16 6.5 3.63 -9.02 -1.07 0
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359280 127297877 1 O2S2N3C17H21 A2B2C3D17E21 -46.19 3.75 -8.64 -0.68 0
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359281 127297878 1 N2O3C20H22 A2B3C20D22 -92.57 3.72 -8.2 0.07 0
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359282 127297879 2 ON2C10H15 AB2C10D15 -98.73 6.43 -8.65 -0.13 0
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359283 127297880 2 ON2C11H20 AB2C11D20 -142.15 4.65 -8.76 0.82 0
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359284 127297881 1 O2N5C21H39 A2B5C21D39 -125.38 3.42 -8.71 0.86 0
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359285 127297882 1 O2N4C21H36 A2B4C21D36 -90.64 4.41 -8.98 0.98 0
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359286 127297883 1 O2N3C19H29 A2B3C19D29 -90.97 2.67 -8.69 0.23 0
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359287 127298219 1 O3N4C15H24 A3B4C15D24 -93.24 1.3 -8.79 0.32 0