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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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191680 78176431 1 N3O3C18H19 A3B3C18D19 -85.94 5.27 -8.92 -0.21 0
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191681 78176432 3 NOC4H5 ABC4D5 -97.51 4.77 -9.17 -0.13 0
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191682 78176433 2 N2O2C6H7 A2B2C6D7 -63.55 2.7 -9.57 -1.29 0
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191683 78176483 2 ON2C6H6 AB2C6D6 -30.43 3.27 -10.33 -0.72 0
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191684 78176749 1 SN3O4C18H23 AB3C4D18E23 -152.83 6.15 -9.19 -0.59 0
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191685 78177560 1 SO6N8C16H16 AB6C8D16E16 -115.45 7.73 -9.31 -2.31 0
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191686 78177897 1 N4O6C17H20 A4B6C17D20 -191.6 6.58 -9.79 -0.83 0
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191687 78178095 1 N4O10C21H28 A4B10C21D28 -421.69 1.18 -9.15 -0.66 0
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191688 78178286 1 O12N13C49H69 A12B13C49D69 -496.37 6.54 -8.92 -0.49 0
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191690 78178288 1 FPK2O9C24H34 ABC2D9E24F34 -603.87 8.66 -7.38 0.06 0
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191691 78178289 1 O8N10C21H26 A8B10C21D26 -208.2 2.82 -9.15 -0.92 0
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191692 78178290 1 N3O4C14H23 A3B4C14D23 -166.2 4.1 -8.98 -0.29 0
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191693 78178291 1 O5N10C32H40 A5B10C32D40 -116.1 8.73 -8.52 -1.2 0
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191694 78178292 1 MnP3N5C10H14O14 AB3C5D10E14F14 -627.21 10.11 0.0 0.0 0
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191695 78178869 1 ClON2C15H19 ABC2D15E19 -40.44 3.62 -9.57 -0.35 0
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191696 78179157 1 N2S2O4H20C27 A2B2C4D20E27 -25.15 2.55 -8.8 -1.13 0
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191697 78179199 1 SO3N5C24H33 AB3C5D24E33 -70.92 5.69 -8.53 0.01 0
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191698 78179365 1 PN3O5C7H12 AB3C5D7E12 -238.81 3.64 -9.48 -0.22 0
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191699 78179389 1 ClON2H9C14 ABC2D9E14 57.47 3.11 -9.65 -1.78 0
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191700 78179525 1 N2O2H12C15 A2B2C12D15 20.18 5.89 -9.14 -1.52 0
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191701 78179544 1 SN4O7C18H24 AB4C7D18E24 -266.87 4.03 -9.3 -0.87 0
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191702 78179545 1 N4O7C11H18 A4B7C11D18 -293.93 6.59 -9.57 -0.36 1
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191703 78179546 1 O3N6C10H11 A3B6C10D11 -35.83 4.64 0.0 0.0 0
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191704 78179646 1 O3N5H11C13 A3B5C11D13 -8.19 7.54 -9.54 -1.66 0
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191705 78179647 1 ON5H13C14 AB5C13D14 88.93 8.1 -9.2 -1.2 0
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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