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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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227491 87561846 1 N4O7C12H26 A4B7C12D26 -345.7 8.18 -10.04 -0.28 0
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227492 87561849 1 NO3C11H21 AB3C11D21 -154.47 1.88 -9.28 0.57 0
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227493 87561850 1 ClN2O2C7H7 AB2C2D7E7 -66.08 5.71 -9.64 -0.87 0
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227494 87561851 1 ON5H15C19 AB5C15D19 117.68 4.01 -8.97 -1.33 0
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227495 87561852 1 O3H14C17 A3B14C17 -33.14 6.89 -9.33 -1.9 0
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227496 87561853 1 O3C17H18 A3B17C18 -30.79 4.11 -9.39 -2.0 0
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227497 87561858 1 BrN4C12H19 AB4C12D19 23.64 4.77 -8.51 -0.62 0
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227498 87561861 2 OC4H7 AB4C7 -59.56 3.58 -10.28 0.59 0
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227499 87561862 2 OC4H7 AB4C7 -59.93 3.57 -10.28 0.62 0
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227500 87561875 1 ClSN4O4C21H23 ABC4D4E21F23 -89.33 2.64 -9.55 -0.99 0
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227501 87561876 1 Cl2S2N8O10C41H42 A2B2C8D10E41F42 -232.57 9.75 -9.53 -1.21 0
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227502 87561878 1 Cl2S2N8O10C41H42 A2B2C8D10E41F42 -225.89 2.23 -9.39 -1.45 0
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227503 87561880 1 SiO6C24H40 AB6C24D40 -300.07 3.65 -9.32 -0.67 0
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227504 87561881 1 SN3O7C25H33 AB3C7D25E33 -263.06 5.84 -9.17 -0.46 0
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227505 87561882 1 SN3O7C25H33 AB3C7D25E33 -262.61 3.85 -9.32 -0.58 0
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227506 87561883 1 OSN3H13C14 ABC3D13E14 37.91 3.28 -8.8 -0.7 0
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227507 87561884 1 F2O3N4H22C26 A2B3C4D22E26 -91.98 1.92 -8.44 -1.03 0
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227508 87561886 1 N2O3C16H20 A2B3C16D20 -61.28 3.84 -8.7 0.48 0
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227509 87561888 1 AsOC8H9 ABC8D9 40.07 1.43 -8.06 -0.41 0
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227510 87561889 1 NO5C17H17 AB5C17D17 -148.84 6.56 -9.38 -0.46 0
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227511 87561893 1 ClLiSO3H11C20 ABCD3E11F20 -90.17 5.82 0.0 0.0 0
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227512 87561894 2 C5O5H9 A5B5C9 -444.35 1.27 -10.4 -1.01 0
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227513 87561896 1 O9C10H16 A9B10C16 -384.64 5.02 -10.72 -0.79 0
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227514 87561897 1 ClNO5C22H24 ABC5D22E24 -144.8 5.49 -8.37 -0.18 0
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227515 87561898 1 SN3O3C17H17 AB3C3D17E17 -20.71 3.65 -9.07 -1.56 1