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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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389969 134996306 1 IOC13H23 ABC13D23 -56.69 3.28 -9.59 -1.01 0
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389970 134996307 1 FN3H4C7O7 AB3C4D7E7 -60.65 3.94 -11.37 -2.51 0
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389971 134996308 1 NBr2O3C9H9 AB2C3D9E9 -42.63 2.84 -9.51 -1.12 0
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389972 134996314 1 O3C14H22 A3B14C22 -121.1 0.71 -9.58 -0.06 0
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389973 134996316 1 SO2C13H20 AB2C13D20 -96.99 1.61 -8.43 0.34 0
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389974 134996317 1 F3O3C13H19 A3B3C13D19 -281.32 3.07 -9.91 -0.65 0
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389975 134996352 1 BrC7H7 AB7C7 58.04 1.59 -9.57 0.15 0
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389976 134996356 1 NO2S2C12H15 AB2C2D12E15 -48.62 3.13 -8.8 -0.64 0
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389977 134996357 1 SN3H5O5C6 AB3C5D5E6 -38.28 2.29 -10.38 -2.4 0
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389978 134996359 1 OTeC12H12 ABC12D12 -2.75 4.03 -8.01 -0.49 0
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389979 134996364 1 NPO2C11H18 ABC2D11E18 -122.95 5.55 -9.28 -0.02 0
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389980 134996365 1 PCl2O2C11H13 AB2C2D11E13 -139.13 5.48 -10.21 -0.57 0
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389981 134996366 1 ClPO2C11H16 ABC2D11E16 -117.7 4.88 -9.18 -0.06 0
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389982 134996370 2 N2H6C7 A2B6C7 160.6 1.23 -8.84 -1.11 0
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389983 134996400 1 ClFNH13C14 ABCD13E14 -16.01 1.16 -8.37 -0.48 0
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389984 134996403 1 SN3O4C7H7 AB3C4D7E7 -69.87 7.87 -9.98 -1.19 0
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389985 134996409 1 FOC16H21 ABC16D21 -81.23 2.79 -8.84 -0.18 0
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389986 134996415 1 SO3C12H14 AB3C12D14 -78.46 5.38 -9.55 -1.19 0
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389987 134996431 1 OSeC8H16 ABC8D16 -13.24 5.67 -8.88 -0.14 0
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389988 134996434 1 N3C10H11 A3B10C11 102.22 2.62 -9.18 -0.2 0
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389989 134996436 1 PSO2C14H15 ABC2D14E15 -83.17 5.84 -8.8 -0.26 0
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389990 134996439 1 NC17H19 AB17C19 62.88 1.67 -8.26 0.21 0
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389991 134996441 1 OPSC14H21 ABCD14E21 -102.09 3.64 -8.73 -0.15 0
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389992 134996443 1 N2S2C11H16 A2B2C11D16 51.14 2.74 -9.09 -1.29 0
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389993 134996449 1 SO3C13H18 AB3C13D18 -81.71 5.43 -8.1 0.23 0
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389994 134996467 1 NPO2C14H24 ABC2D14E24 -113.04 1.02 -7.9 0.63 0
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389995 134996468 1 NPO6C8H10 ABC6D8E10 -209.96 4.52 -10.16 -1.34 0
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389996 134996500 1 SO2N5C7H7 AB2C5D7E7 45.97 2.77 -10.12 -1.64 0
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389997 134996501 1 OC12H16 AB12C16 18.24 2.51 -8.82 0.71 0
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389998 134996502 1 Br2O2H8C9 A2B2C8D9 -20.49 0.6 -9.99 -0.76 0
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389999 134996506 2 NOC6H9 ABC6D9 -17.41 5.57 -9.68 -0.58 0
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390000 134996509 1 NSiC15H25 ABC15D25 -36.68 1.97 -7.91 0.74 0
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390001 134996512 1 O3C12H14 A3B12C14 -119.98 5.72 -10.07 0.26 0
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390002 134996515 1 OS2C8H14 AB2C8D14 -45.28 2.49 -8.08 0.34 0
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390003 134996542 1 PBr2O4C8H11 AB2C4D8E11 -228.91 4.35 -10.7 -0.88 0
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390004 134996544 1 NPO2C14H20 ABC2D14E20 -132.03 4.9 -9.97 -0.38 0
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390005 134996548 1 NC14H19 AB14C19 21.87 1.92 -7.98 0.61 0
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390006 134996552 1 P2O7C8H18 A2B7C8D18 -417.0 1.66 -9.29 0.36 0
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390007 134996554 2 NSC6H8 ABC6D8 68.8 2.74 -9.07 -1.29 0
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390008 134996556 1 S3C11H14 A3B11C14 32.9 1.03 -8.5 -1.14 0
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390009 134996561 2 SC7H12 AB7C12 -15.27 0.27 -7.72 0.48 0
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390010 134996568 1 PO2C12H25 AB2C12D25 -148.43 7.75 -9.43 0.67 0
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390011 134996569 1 BrNSSeO2H8C9 ABCDE2F8G9 51.21 5.26 -8.9 -1.52 0
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390012 134996570 1 BrSe2C10H11 AB2C10D11 38.48 2.05 -8.23 -0.82 0
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390013 134996578 1 NPO4C11H16 ABC4D11E16 -135.55 1.06 -9.88 -0.48 0
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390014 134996582 1 PO2C13H15 AB2C13D15 -100.09 3.28 -9.07 -0.66 0
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390015 134996584 1 NBr3C11H22 AB3C11D22 -21.49 11.11 -8.05 -1.19 0
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390016 134996588 1 NB2Br2C11H17 AB2C2D11E17 -123.96 3.06 -9.15 -0.37 0
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390017 134996594 1 OS2C12H18 AB2C12D18 -71.19 4.49 -8.72 -0.02 0
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390018 134996597 1 O4C13H14 A4B13C14 -129.19 4.65 -9.63 -0.38 0
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390019 134996623 1 NOSC13H17 ABCD13E17 -5.84 2.85 -7.99 0.28 0
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390020 134996644 1 NPO2C12H20 ABC2D12E20 -126.19 5.21 -9.15 -0.06 0
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390021 134996645 1 NPO3C12H18 ABC3D12E18 -162.03 2.32 -9.37 -0.1 0
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390022 134996649 1 N2O5H10C11 A2B5C10D11 -88.13 5.72 -9.34 -1.4 0
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390023 134996661 1 SO2F3C12H19 AB2C3D12E19 -266.45 3.21 -9.13 -1.2 0
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390024 134996671 1 PO5C11H21 AB5C11D21 -286.61 2.01 -10.3 -0.1 0
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390025 134996673 1 SN2C12H12 AB2C12D12 58.52 0.6 -8.52 -0.85 1
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390026 134996679 1 BOPC7H9 ABCD7E9 76.03 3.35 0.0 0.0 0
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390027 134996683 1 OPSC19H25 ABCD19E25 -75.66 4.04 -8.48 0.17 0
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390028 134996692 1 N3C29H39 A3B29C39 44.1 3.15 -9.38 -1.14 0
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390029 134996694 1 NPO3H24C32 ABC3D24E32 48.66 6.94 -9.03 -0.9 0
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390030 134996695 1 ON5C21H21 AB5C21D21 78.41 6.34 -8.75 -1.09 0
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390031 134996700 1 ClOSN3H14C17 ABCD3E14F17 90.37 2.19 -8.87 -1.68 0
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390032 134996713 1 IPN2O4C15H18 ABC2D4E15F18 -162.99 5.77 -9.2 -1.21 0
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390033 134996723 1 N2O4C19H22 A2B4C19D22 -84.83 2.83 -9.45 -0.36 0
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390034 134996726 1 TiO4C23H34 AB4C23D34 -114.44 24.11 -6.79 -4.03 0
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390035 134996727 1 NOC17H19 ABC17D19 39.13 4.15 -8.54 -0.3 0
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390037 134996737 1 NO20C27H47 AB20C27D47 -904.88 8.36 -10.06 0.05 0
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390038 134996744 1 NSiO6C22H37 ABC6D22E37 -288.9 1.81 -9.0 0.43 0
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390039 134996746 1 CrO4C17H18 AB4C17D18 -90.65 3.24 -7.33 0.49 0
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390040 134996762 1 OSSiN3C13H17 ABCD3E13F17 21.96 6.55 -8.9 -0.44 0
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390041 134996770 1 CrSiO6C29H36 ABC6D29E36 -230.35 2.4 -7.4 -0.59 0
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390042 134996791 1 NSC15H21 ABC15D21 35.62 0.86 -8.48 0.0 0
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390043 134996792 1 NOSiC24H37 ABCD24E37 -60.04 0.12 -8.8 0.03 0
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390045 134996794 1 OSN2C12H16 ABC2D12E16 -11.62 1.34 -8.75 -0.38 0