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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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308206 125317254 1 FN4H17C21 AB4C17D21 77.55 5.42 -9.21 -1.26 0
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308207 125317255 1 FN4H17C21 AB4C17D21 77.09 5.71 -9.23 -1.29 0
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308208 125317256 1 O5N6C12H12 A5B6C12D12 16.15 8.82 -9.04 -2.37 0
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308209 125317257 1 O5N6C12H12 A5B6C12D12 16.37 8.67 -9.04 -2.37 0
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308210 125317258 1 N3O3H15C16 A3B3C15D16 -37.98 3.45 -8.71 -0.57 0
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308211 125317259 1 N3O3H15C16 A3B3C15D16 -37.55 2.32 -8.76 -0.56 0
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308212 125321478 1 C24O25H34 A24B25C34 -1073.13 11.89 -10.51 -0.53 0
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308213 125321484 1 SF3O3N5H20C22 AB3C3D5E20F22 -207.21 0.67 -8.63 -1.52 0
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308214 125321551 1 ClSi4O8C35H59 AB4C8D35E59 -539.27 3.99 -8.72 -0.2 0
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308215 125321614 1 S2N3O4C25H29 A2B3C4D25E29 -100.2 9.26 -8.72 -1.68 0
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308216 125321695 1 NO2C14H27 AB2C14D27 -108.8 3.21 -9.5 0.29 0
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308217 125321755 1 N3C7H11 A3B7C11 73.08 4.92 -9.96 -0.42 0
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308218 125321774 1 ClNC11H12 ABC11D12 32.54 3.8 -8.7 -1.18 0
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308219 125321788 1 ClO3N4H19C22 AB3C4D19E22 36.2 2.64 -8.69 -1.14 0
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308220 125321798 1 SO2N4H20C22 AB2C4D20E22 33.68 8.62 -8.87 -0.99 0
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308221 125321867 1 NPO3C25H36 ABC3D25E36 -166.27 3.78 -8.35 0.29 0
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308222 125323199 1 N6O6C25H26 A6B6C25D26 -178.47 4.37 -8.9 -1.2 1
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308224 125323604 1 FN2S2O4H11C20 AB2C2D4E11F20 -30.95 7.79 -8.7 -2.06 0
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308225 125323619 1 SO2N6C13H16 AB2C6D13E16 -0.44 2.86 -9.49 -1.4 0
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308226 125323620 1 SO2N6C13H16 AB2C6D13E16 0.89 5.53 -8.91 -1.68 0
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308227 125323621 1 SO2N6C13H16 AB2C6D13E16 0.92 5.13 -8.92 -1.68 0
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308229 125323735 2 O2N3C9H11 A2B3C9D11 -33.07 5.8 -9.43 -1.34 0
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308230 125323878 1 BrFN2O3H18C27 ABC2D3E18F27 -40.89 4.95 -9.05 -0.85 0
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308231 125323882 1 N3O4C26H33 A3B4C26D33 -137.87 8.93 -8.61 -0.48 0
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308234 125324330 1 SN2O5C16H16 AB2C5D16E16 -130.31 6.61 -9.45 -0.88 0
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308235 125324331 1 ClOF3N4H12C18 ABC3D4E12F18 -43.6 4.3 -9.56 -1.72 0
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308236 125324333 1 NO6C18H25 AB6C18D25 -253.76 7.03 -8.86 0.07 0
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308237 125324334 1 O3S3N7C15H17 A3B3C7D15E17 -11.88 4.34 -8.67 -1.45 0
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308238 125324350 1 N3O3C23H23 A3B3C23D23 -19.58 6.11 -8.71 -1.97 0
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308239 125324357 1 S2O4N5C16H19 A2B4C5D16E19 -45.64 4.99 -9.16 -1.59 0
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308241 125324385 1 SO4N5C19H19 AB4C5D19E19 -71.91 5.15 -9.36 -1.32 0
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308242 125324386 1 ClO3N4C17H17 AB3C4D17E17 -28.09 4.41 -8.99 -1.46 0
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308243 125324393 2 NO3C14H16 AB3C14D16 -94.2 6.22 -8.78 -0.66 0
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308245 125324406 1 SO3N4H26C29 AB3C4D26E29 29.77 5.57 -8.72 -2.19 0
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308246 125324427 1 FN3O4C22H26 AB3C4D22E26 -154.58 9.66 -8.59 -0.76 0
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308247 125324500 1 O12C27H38 A12B27C38 -478.59 5.05 -9.35 -0.85 0
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308248 125324502 1 O12C27H38 A12B27C38 -480.16 4.63 -9.24 -0.68 0
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308249 125324602 1 N4O5H14C18 A4B5C14D18 -45.0 9.74 -9.67 -1.76 0
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308250 125324615 1 NO5H23C26 AB5C23D26 -133.72 6.68 -9.62 -1.85 0
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308251 125324636 1 FNS2O4C18H26 ABC2D4E18F26 -212.52 3.57 -9.04 -0.6 0
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308252 125324656 1 O2N7C17H21 A2B7C17D21 34.39 5.94 -8.78 -0.76 0
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308253 125324657 1 O2N7C17H21 A2B7C17D21 36.76 7.68 -8.99 -0.92 0
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308254 125324710 1 ClH2N3C4O4 AB2C3D4E4 -56.85 2.37 -11.72 -2.3 0
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308255 125324808 1 O2N5C18H25 A2B5C18D25 -21.85 2.7 -9.16 -0.96 0
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308256 125324893 1 S3N8O8H18C20 A3B8C8D18E20 -94.3 3.84 -9.23 -2.2 0
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308257 125324976 1 BrON3H6C8 ABC3D6E8 47.57 3.78 -9.4 -1.57 0
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308258 125324978 1 N4O4C35H36 A4B4C35D36 -62.58 7.93 -9.02 -1.5 0
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308259 125324987 1 ON5C23H23 AB5C23D23 83.68 5.79 -8.86 -0.9 0
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308260 125325046 1 O2N3C25H27 A2B3C25D27 -4.3 3.32 -9.06 -1.14 0
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308263 125325050 1 ClOS2N4H23C26 ABC2D4E23F26 110.52 5.85 -8.75 -1.3 0
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308264 125325051 1 ClOS2N4H23C26 ABC2D4E23F26 107.98 5.09 -8.77 -1.35 0
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308265 125325172 1 SN3O3C13H15 AB3C3D13E15 -57.19 5.04 -9.44 -1.26 0
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308266 125325176 1 ClO2N4H21C22 AB2C4D21E22 -1.82 5.81 -8.51 -1.17 0
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308267 125325179 1 ClO3N4H11C12 AB3C4D11E12 -83.0 2.67 -8.86 -1.1 0
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308268 125325180 2 NOC7H8 ABC7D8 -6.0 6.7 -8.96 -0.94 0
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308269 125325189 1 O3N4C24H24 A3B4C24D24 -35.31 6.33 -8.85 -1.2 0
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308270 125325239 1 ClN2O2H15C17 AB2C2D15E17 18.99 7.32 -8.61 -1.46 1
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308272 125325247 1 NO9C29H35 AB9C29D35 -368.69 3.48 -9.72 -0.2 0
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308274 125325337 1 O3N5H13C15 A3B5C13D15 -34.83 2.06 -9.2 -1.26 0
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308275 125325445 1 ClOSN7H20C21 ABCD7E20F21 112.77 2.69 -8.68 -1.94 0
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308276 125325463 1 SO2N7C21H21 AB2C7D21E21 89.57 7.1 -8.79 -1.6 0
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308278 125325588 2 N2O6C15H22 A2B6C15D22 -556.38 5.96 -9.3 -0.15 0
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308279 125325616 1 N2O7C29H32 A2B7C29D32 -180.86 5.44 -8.09 -1.12 0
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308280 125325622 1 N3O3H17C20 A3B3C17D20 -25.0 6.98 -8.77 -1.07 0
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308282 125325696 1 SO3N6C20H22 AB3C6D20E22 -18.98 4.54 -9.1 -1.61 0
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308283 125325702 1 N2O4H16C17 A2B4C16D17 -56.84 7.0 -8.26 -0.7 0
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308284 125325705 1 ClON5H18C21 ABC5D18E21 59.66 8.63 -9.07 -1.55 0
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308286 125325717 1 N4O7C21H26 A4B7C21D26 -250.74 10.62 -9.41 -1.71 0
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308287 125325721 1 O2N4C15H18 A2B4C15D18 24.69 9.05 -9.1 -1.52 0
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308288 125325759 1 O3N4H26C29 A3B4C26D29 -6.49 6.0 -9.24 -1.4 0
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308289 125325775 1 OH20C23 AB20C23 215.73 2.84 -9.97 1.03 0
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308290 125325790 1 INO8H26C29 ABC8D26E29 -211.46 4.77 -8.76 -1.19 0
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308291 125325809 1 SP3N7O18C27H44 AB3C7D18E27F44 -948.27 7.67 -9.44 -0.92 0
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308292 125325916 1 O3N5C9H9 A3B5C9D9 3.31 4.34 -10.07 -2.24 0
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308293 125326006 1 O3N6C17H22 A3B6C17D22 -47.76 5.43 -9.31 -1.57 0