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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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405722 135075159 1 O5C29H48 A5B29C48 -210.47 1.8 -9.45 0.27 0
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405723 135075160 1 O2Cl3H7C9 A2B3C7D9 -51.28 3.53 -8.9 -0.47 0
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405724 135075162 1 BrNO4C25H36 ABC4D25E36 -167.39 3.04 -9.61 0.02 0
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405725 135075163 1 NO2C21H25 AB2C21D25 -16.81 4.79 -8.76 -0.29 0
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405726 135075164 1 SiO4C29H46 AB4C29D46 -244.12 1.06 -8.78 0.62 0
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405727 135075165 6 OC3H3 AB3C3 -208.67 2.67 -9.12 -1.26 0
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405728 135075167 1 O5C12H18 A5B12C18 -209.03 1.97 -10.36 0.06 0
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405729 135075169 1 O5C16H16 A5B16C16 -130.54 4.48 -9.81 -0.7 0
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405730 135075170 1 SiO4C36H48 AB4C36D48 -164.02 1.81 -9.04 0.04 0
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405731 135075186 1 O5C15H16 A5B15C16 -134.41 4.88 -8.67 -1.44 0
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405732 135075189 1 ClN2O2C25H29 AB2C2D25E29 -28.71 2.99 -8.77 -0.2 0
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405733 135075195 1 BrClN2O2H24C27 ABC2D2E24F27 20.59 3.31 -9.08 -0.97 0
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405734 135075196 1 N2O2H26C27 A2B2C26D27 41.56 2.45 -8.96 -0.55 0
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405735 135075228 2 OC9H9 AB9C9 -1.69 3.2 -8.83 -0.2 0
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405736 135075258 1 ON2H16C19 AB2C16D19 38.2 3.59 -8.59 -0.75 1
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405737 135075280 1 BrO2N3H19C20 AB2C3D19E20 69.78 4.22 0.0 0.0 0
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405738 135075283 1 N3O4C6H11 A3B4C6D11 -119.13 3.31 -10.26 -0.38 0
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405739 135075284 1 FN3O4C6H10 AB3C4D6E10 -162.9 3.83 -10.27 -0.39 0
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405740 135075285 1 O4H16C21 A4B16C21 -75.92 6.37 -9.7 -0.87 0
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405741 135075286 1 NSnC22H31 ABC22D31 36.9 2.33 -8.36 0.21 0
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405742 135075287 1 BN2S2C17H19 AB2C2D17E19 33.81 7.29 -7.79 -0.08 0
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405743 135075288 1 ClSO2N3H10C13 ABC2D3E10F13 18.67 2.71 -9.18 -0.94 0
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405744 135075289 1 NSO4C23H25 ABC4D23E25 -128.37 3.13 -8.57 -0.49 0
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405745 135075290 1 BrO2H15C18 AB2C15D18 -0.97 2.68 -8.78 -0.5 0
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405746 135075292 1 ClO3H11C15 AB3C11D15 -58.09 4.19 -9.68 -0.9 0
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405747 135075293 1 ClO3H13C16 AB3C13D16 -72.31 4.65 -9.63 -0.92 0
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405748 135075294 1 SiO2C17H20 AB2C17D20 -32.12 1.95 -8.81 0.22 0
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405749 135075295 1 NOC15H27 ABC15D27 -80.42 4.11 -9.14 1.34 0
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405750 135075296 1 NaSO4C7H11 ABC4D7E11 -200.88 10.25 -10.37 0.46 0
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405751 135075301 1 NOH25C29 ABC25D29 58.53 4.0 -8.91 -0.61 0
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405752 135075303 1 SN2O5C18H20 AB2C5D18E20 -65.1 4.79 -8.61 -1.96 0
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405753 135075304 1 NSO2C26H43 ABC2D26E43 -125.92 5.92 -9.44 -0.19 0
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405754 135075305 1 NSO2C21H35 ABC2D21E35 -108.82 5.93 -9.44 -0.2 0
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405755 135075306 1 NSO5C19H21 ABC5D19E21 -157.28 4.89 -9.45 -0.62 0
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405756 135075307 1 NSO6C16H21 ABC6D16E21 -246.23 4.67 -10.22 -0.6 0
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405757 135075309 1 BrNO2C17H22 ABC2D17E22 -53.15 4.82 -9.15 -0.25 0
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405758 135075311 1 NSF3O5C23H24 ABC3D5E23F24 -306.44 2.07 -9.29 -1.58 0
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405759 135075312 1 O6C25H26 A6B25C26 -209.85 4.42 -9.68 -1.13 0
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405760 135075313 1 NaCl2O2H11C15 AB2C2D11E15 -101.52 10.95 -8.92 -0.7 0
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405761 135075314 1 ON2C16H18 AB2C16D18 -1.58 2.77 -9.33 -0.7 0
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405762 135075315 1 ON2C17H20 AB2C17D20 -8.66 2.43 -9.33 -0.7 0
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405763 135075316 2 O2C7H7 A2B7C7 -137.53 4.99 -9.65 -0.76 0
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405764 135075319 1 NSO4H17C20 ABC4D17E20 -74.79 5.31 -8.72 -0.48 0
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405765 135075338 1 BrNSO2H14C15 ABCD2E14F15 -29.9 6.4 -9.3 -0.82 0
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405766 135075339 1 NSO3C16H21 ABC3D16E21 -98.46 9.15 -10.01 -0.54 0
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405767 135075347 1 SiO2C13H24 AB2C13D24 -122.7 2.19 -8.89 0.97 -2
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405768 135075376 1 P2C5H10O10 A2B5C10D10 -382.47 3.71 -10.57 -3.79 0
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405769 135075389 1 NO2C14H23 AB2C14D23 -99.34 1.64 -8.59 0.14 0
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405770 135075428 1 FSiC12H27 ABC12D27 -165.7 2.04 -9.84 0.67 0
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405771 135075429 1 O4C9H16 A4B9C16 -200.62 3.25 -10.97 0.46 0