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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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149755 53789431 1 BrSO3H13C14 ABC3D13E14 -81.63 2.63 -9.44 -1.27 0
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149756 53789432 1 NO2C24H31 AB2C24D31 -76.84 2.58 -9.01 -0.32 0
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149757 53789433 1 O5C29H30 A5B29C30 -133.33 3.93 -8.52 -0.77 0
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149758 53789434 1 Si2O3C39H70 A2B3C39D70 -294.97 3.95 -8.7 0.38 0
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149759 53789435 1 C11H20 A11B20 -29.36 0.49 -9.08 1.57 0
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149760 53789436 1 C11H20 A11B20 -29.6 0.49 -9.09 1.57 0
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149761 53789437 1 NPC6O7H14 ABC6D7E14 -239.12 5.34 -10.07 -0.99 0
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149762 53789438 1 SN5O5C23H33 AB5C5D23E33 -199.25 6.87 -8.98 -0.49 0
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149763 53789439 1 ON2Si2C7H19 AB2C2D7E19 -58.73 0.75 0.0 0.0 0
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149764 53789440 1 N2O4C19H32 A2B4C19D32 -181.17 5.82 -9.44 0.64 0
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149765 53789441 1 ClF2S2N6O8C24H25 AB2C2D6E8F24G25 -325.4 4.52 -8.91 -1.07 0
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149766 53789442 1 FSO2N3C8H8 ABC2D3E8F8 -68.19 4.61 -8.78 -0.54 0
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149767 53789443 1 FSN3O4C12H12 ABC3D4E12F12 -153.24 3.26 -9.04 -0.97 0
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149768 53789444 1 N6O7C24H30 A6B7C24D30 -237.6 2.77 -8.94 -0.4 0
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149769 53789445 1 NO2C18H27 AB2C18D27 -50.09 0.99 -9.59 -0.72 0
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149770 53789446 1 FNC27H32 ABC27D32 -7.18 6.33 -9.32 -0.78 0
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149771 53789447 1 ClSN4C8H17 ABC4D8E17 -4.56 4.75 -8.97 -0.01 0
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149772 53789448 1 O3C16H20 A3B16C20 -73.76 2.22 -8.87 0.13 0
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149773 53789449 1 BrO4C5H9 AB4C5D9 -180.78 2.9 -10.67 -0.49 1
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149774 53789450 1 ClO2N5C17H23 AB2C5D17E23 -32.4 6.01 0.0 0.0 0
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149775 53789451 2 NOC2H6 ABC2D6 -69.26 1.69 -9.52 1.39 0
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149776 53789452 1 SO4N7C19H23 AB4C7D19E23 -3.41 2.02 -8.8 -1.15 0
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149777 53789453 1 SO2N3C18H19 AB2C3D18E19 -6.68 3.67 -8.74 -0.92 0
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149778 53789454 1 SF3O9H13C14 AB3C9D13E14 -504.66 2.53 -10.58 -2.1 0
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149779 53789455 1 NO2C20H29 AB2C20D29 -86.71 3.19 -9.55 -0.05 0