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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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191706 78179648 1 SO3N5C16H19 AB3C5D16E19 -23.6 6.36 -9.26 -1.37 0
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191707 78179649 1 ClOF2N4C10H11 ABC2D4E10F11 -119.37 4.82 -9.16 -0.62 0
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191708 78179906 1 Si2N3O7C23H43 A2B3C7D23E43 -402.42 5.34 -8.83 -0.07 0
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191709 78179928 1 PN8O11C37H63 AB8C11D37E63 -533.91 7.44 -9.44 -0.4 0
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191710 78180068 1 SCl3N4H13C18 AB3C4D13E18 119.11 2.03 -9.07 -1.65 0
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191711 78180069 1 ClOSN4H17C22 ABCD4E17F22 112.48 1.63 -8.8 -1.52 0
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191712 78180253 1 ClO2N4C12H21 AB2C4D12E21 -132.26 10.19 -9.2 -0.21 0
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191713 78180254 2 ON2C6H10 AB2C6D10 -93.75 4.97 -9.08 0.14 0
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191714 78180255 1 ClO2N4C15H27 AB2C4D15E27 -144.75 5.89 -9.16 -0.03 0
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191715 78180318 1 N3O3H17C18 A3B3C17D18 -83.64 3.6 -9.12 -0.26 0
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191716 78180621 1 SO3N6C34H48 AB3C6D34E48 -121.24 7.62 -8.47 -0.18 0
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191717 78180622 2 NO2S2C11H12 AB2C2D11E12 -117.82 8.24 -8.77 -1.19 0
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191718 78181038 1 NOH25C28 ABC25D28 68.47 1.18 -7.82 0.09 0
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191719 78181251 1 BrPC12H18 ABC12D18 -27.12 15.26 -7.5 -1.11 0
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191720 78181536 1 N3O4C23H25 A3B4C23D25 -142.16 3.12 -9.07 -0.72 1
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191721 78181674 1 O3N5C8H8 A3B5C8D8 -42.23 5.6 0.0 0.0 0
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191722 78181676 1 N3O9C13H19 A3B9C13D19 -389.99 5.84 -10.57 -0.73 0
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191723 78181677 1 N2F3O4C11H11 A2B3C4D11E11 -306.56 3.69 -10.36 -1.25 0
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191724 78181678 1 N3O4C9H11 A3B4C9D11 -120.74 2.47 -9.68 -1.09 0
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191725 78182089 1 NO5C17H19 AB5C17D19 -159.53 3.4 -9.0 -0.37 0
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191726 78182172 1 NO3C22H25 AB3C22D25 -54.27 3.64 -9.15 -0.01 0
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191727 78182305 1 ON2S2H14C21 AB2C2D14E21 115.96 2.92 -8.89 -1.54 0
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191728 78182360 1 SN2O6C26H30 AB2C6D26E30 -192.63 6.43 -9.43 -0.43 0
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191729 78182558 1 ON3H9C14 AB3C9D14 67.38 1.66 -8.93 -1.46 0
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191730 78182559 1 ON3C20H27 AB3C20D27 -24.0 4.65 -9.27 0.12 0