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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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173286 75618458 2 NO2H8C9 AB2C8D9 -95.01 9.17 -8.43 -0.91 0
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173287 75618459 1 SN2O3H12C15 AB2C3D12E15 -49.6 5.78 -8.54 -1.34 0
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173288 75618460 1 O3N4C21H30 A3B4C21D30 -137.42 3.78 -8.54 0.22 0
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173289 75619004 1 BrN2O3C13H17 AB2C3D13E17 -72.45 1.34 -9.02 -0.9 0
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173290 75619005 1 N2O4C17H24 A2B4C17D24 -126.04 2.36 -8.4 -0.45 0
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173291 75619482 1 N2O2C19H26 A2B2C19D26 -53.34 0.78 -9.43 -0.54 0
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173292 75619643 1 SN3O3H15C18 AB3C3D15E18 -9.46 8.13 -9.6 -1.86 0
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173293 75619857 1 N2O2C19H26 A2B2C19D26 -69.79 3.25 -8.27 -0.31 0
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173294 75620702 1 N3O3C19H19 A3B3C19D19 -23.43 4.99 -9.46 -1.47 0
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173295 75620704 1 O2N3C22H25 A2B3C22D25 -7.4 6.76 -8.99 -1.62 0
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173296 75620826 1 ClON4C20H25 ABC4D20E25 30.7 3.95 -9.21 -0.32 0
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173297 75621085 1 ClO2N4C20H21 AB2C4D20E21 19.07 4.77 -8.25 -2.12 0
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173298 75621175 1 SN3O3C20H23 AB3C3D20E23 -21.56 8.1 -8.6 -1.71 0
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173299 75621176 1 OS2N3C18H19 AB2C3D18E19 49.43 3.45 -8.8 -1.3 0
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173300 75621177 1 SN3O3C19H21 AB3C3D19E21 -17.95 8.23 -8.74 -1.7 0
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173301 75621178 1 S2N3O3C18H19 A2B3C3D18E19 -42.88 3.11 -8.98 -1.45 0
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173302 75621179 1 SO2N3H17C19 AB2C3D17E19 37.33 5.43 -8.79 -1.8 0
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173303 75621249 1 ClN3O4C17H18 AB3C4D17E18 -69.86 5.31 -8.76 -0.44 0
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173304 75621313 1 FOSN2H11C12 ABCD2E11F12 11.78 1.58 -8.88 -0.6 0
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173305 75621330 1 SN3O3C15H17 AB3C3D15E17 -26.21 3.7 -8.45 -0.45 0
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173306 75621738 3 NOC6H7 ABC6D7 -39.96 4.72 -8.95 -0.08 0
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173307 75621965 1 SN2O5H16C17 AB2C5D16E17 -68.76 5.27 -9.27 -1.5 0
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173308 75622276 1 N3O4C21H31 A3B4C21D31 -140.41 4.17 -8.66 -0.06 0
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173309 75622277 1 NSO2C16H17 ABC2D16E17 -19.48 3.52 -9.05 -0.74 1
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173310 75622649 1 SF2N3O5C15H18 AB2C3D5E15F18 -271.86 5.48 0.0 0.0 0
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173311 75622650 1 SO4N5C16H21 AB4C5D16E21 -113.8 4.35 -8.82 -0.59 1
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173312 75622651 1 ClSN4O4C17H24 ABC4D4E17F24 -152.45 2.23 0.0 0.0 1
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173313 75622652 1 SN3O4C18H26 AB3C4D18E26 -149.44 2.71 0.0 0.0 0
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173314 75622653 1 SN3O4C15H21 AB3C4D15E21 -142.66 1.92 -9.56 -0.44 0
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173315 75622654 1 ClNSO4C14H20 ABCD4E14F20 -137.15 4.17 -9.78 -1.05 0
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173316 75622655 2 NSO2C8H9 ABC2D8E9 -95.17 11.11 -9.9 -1.13 0
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173317 75622656 1 ClSN2O2C20H23 ABC2D2E20F23 -28.37 4.17 -9.03 -0.83 0
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173318 75622657 1 NSO4C16H23 ABC4D16E23 -134.91 5.1 -9.76 -0.79 0
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173319 75622658 1 SN3O5C15H21 AB3C5D15E21 -179.96 1.73 -8.78 -0.46 0
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173320 75622659 1 ClNSO4C14H18 ABCD4E14F18 -156.34 6.0 -9.8 -1.21 1
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173321 75622660 1 SN3O6C12H20 AB3C6D12E20 -247.41 6.63 0.0 0.0 0
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173322 75623035 1 ClSN2O4H15C16 ABC2D4E15F16 -98.41 7.94 -9.43 -1.14 0
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173323 75623036 1 SN2O6C18H20 AB2C6D18E20 -177.38 10.52 -8.62 -0.67 0
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173324 75623037 1 FSN2O4H15C16 ABC2D4E15F16 -138.42 3.99 -9.63 -0.98 0
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173325 75623200 1 ClN3O3C17H18 AB3C3D17E18 -51.27 6.6 -8.85 -0.4 0
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173326 75623224 1 O3N4C19H26 A3B4C19D26 -119.84 4.65 -8.61 -0.12 0
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173327 75623225 1 O2F3N5C18H22 A2B3C5D18E22 -205.68 2.72 -9.31 -1.04 0
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173328 75623226 1 N2O4C19H26 A2B4C19D26 -157.57 4.59 -8.9 -0.78 0
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173329 75623549 1 NO5C21H21 AB5C21D21 -151.49 3.05 -9.11 -0.92 0
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173330 75624512 1 FN3O3C20H26 AB3C3D20E26 -117.51 7.08 -9.01 -0.69 0
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173331 75624513 1 O2N5C22H27 A2B5C22D27 13.91 6.76 -8.95 -0.92 0
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173332 75624514 1 N3O3C23H29 A3B3C23D29 -64.78 1.73 -9.02 -0.56 0
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173333 75624526 1 N2O4C21H22 A2B4C21D22 -79.55 6.23 -8.63 -0.85 0
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173334 75624562 1 N3O3C17H17 A3B3C17D17 -56.05 7.64 -8.19 -0.84 0
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173335 75624660 1 SO2N4C19H22 AB2C4D19E22 3.8 8.75 -8.61 -1.02 0