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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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235616 92710176 1 N2O2C21H22 A2B2C21D22 -15.14 5.43 -8.45 -0.04 0
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235617 92710179 1 ON2C17H20 AB2C17D20 1.22 3.94 -8.76 0.13 0
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235618 92710180 1 ClON2H19C20 ABC2D19E20 13.27 2.46 -8.95 -0.36 0
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235619 92710181 1 ClON2H19C20 ABC2D19E20 15.04 4.2 -9.16 -0.18 0
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235620 92710182 1 ON2C21H22 AB2C21D22 13.62 4.44 -8.71 0.08 0
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235621 92710184 1 N2O3C21H22 A2B3C21D22 -48.27 1.23 -8.67 -0.26 0
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235622 92710187 1 O2N3C25H27 A2B3C25D27 -6.24 7.81 -8.51 -0.25 0
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235623 92710190 1 N2O3H18C20 A2B3C18D20 -32.44 3.13 -8.64 -0.34 0
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235624 92710218 1 N2O3C23H26 A2B3C23D26 -53.27 5.01 -8.52 -0.06 0
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235625 92710219 1 N2O3C23H26 A2B3C23D26 -52.79 1.75 -8.28 -0.06 0
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235626 92710227 2 ON2C12H14 AB2C12D14 -7.5 3.43 -8.55 -0.35 0
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235627 92710228 1 O2N4C23H26 A2B4C23D26 10.21 3.99 -8.22 -0.31 0
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235628 92710230 1 ClO2N3C21H22 AB2C3D21E22 -40.08 4.33 -8.66 -0.22 0
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235629 92710233 2 NOC10H10 ABC10D10 -41.7 7.16 -8.54 -0.18 0
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235630 92710245 1 ClN2O4C19H19 AB2C4D19E19 -127.83 6.46 -8.38 -0.32 0
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235631 92710246 1 N2O4H18C19 A2B4C18D19 -108.2 3.45 -8.75 -0.24 0
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235632 92710249 1 N2O4C19H20 A2B4C19D20 -115.91 2.76 -8.27 -0.17 0
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235633 92710252 2 NOC10H11 ABC10D11 -59.96 2.1 -8.9 -0.11 0
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235634 92710255 1 N2O4H18C19 A2B4C18D19 -114.82 3.02 -8.23 -0.3 0
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235635 92710256 1 O2N3C21H21 A2B3C21D21 -33.4 4.78 -8.34 -0.22 0
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235636 92710259 1 N2O3C17H24 A2B3C17D24 -133.56 2.87 -8.8 0.01 0
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235637 92710260 1 SN3O4C19H21 AB3C4D19E21 -125.92 8.65 -9.12 -0.55 0
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235638 92710261 1 SN3O4C19H21 AB3C4D19E21 -126.26 8.77 -9.12 -0.55 0
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235639 92710268 1 O2N3C22H23 A2B3C22D23 -43.59 4.01 -8.36 -0.07 0
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235640 92710270 1 ClO2N3H20C21 AB2C3D20E21 -42.86 2.52 -8.6 -0.31 0