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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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229676 87568408 1 Cl2N3O5H23C24 A2B3C5D23E24 -106.58 5.6 -8.92 -1.21 1
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229677 87568409 1 ClNOH21C23 ABCD21E23 40.31 5.59 0.0 0.0 0
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229678 87568410 1 O4C17H32 A4B17C32 -243.29 8.32 -10.54 0.55 0
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229679 87568413 1 FNO6C8H10 ABC6D8E10 -300.03 7.19 -10.93 -0.94 0
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229680 87568416 1 FN2O4C22H23 AB2C4D22E23 -119.08 7.69 -8.95 -1.17 0
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229681 87568418 2 NO2H13C14 AB2C13D14 -14.19 7.26 -9.0 -1.03 0
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229682 87568430 1 FN3O4C26H30 AB3C4D26E30 -135.95 6.01 -9.01 -0.67 0
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229683 87568431 1 FN3O4C26H30 AB3C4D26E30 -135.95 6.01 -9.01 -0.67 0
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229684 87568442 1 SN4O8C29H36 AB4C8D29E36 -279.3 13.62 -8.89 -0.69 0
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229685 87568445 1 FSO3N5C21H24 ABC3D5E21F24 -30.74 9.38 -9.38 -0.67 0
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229686 87568457 1 NSiC6H14 ABC6D14 32.23 2.37 0.0 0.0 0
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229687 87568459 1 OSC7H14 ABC7D14 -46.52 4.88 -8.84 -0.58 0
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229688 87568466 2 O2C9H16 A2B9C16 -231.55 3.89 -10.05 0.24 0
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229689 87568467 1 ClFSO3N4C24H30 ABCD3E4F24G30 -103.75 5.76 -8.83 -0.44 0
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229690 87568471 1 S2O4N6C7H14 A2B4C6D7E14 -135.27 4.84 -9.6 -1.66 0
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229691 87568478 1 OSN3C12H17 ABC3D12E17 2.25 5.03 -9.16 -0.29 0
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229693 87568496 1 PSF2N2O6C30H37 ABC2D2E6F30G37 -373.78 4.77 -9.14 -0.81 0
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229694 87568497 1 PSF2N2O6C30H37 ABC2D2E6F30G37 -374.4 4.7 -9.07 -0.88 0
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229695 87568500 1 O5C12H26 A5B12C26 -274.1 6.86 -9.98 0.39 0
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229696 87568511 1 N11O15C62H113 A11B15C62D113 -794.3 8.72 -9.39 -0.01 0
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229697 87568513 1 NOC26H33 ABC26D33 23.19 3.94 -8.33 0.12 0
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229698 87568517 1 OSCl2N4C25H28 ABC2D4E25F28 37.74 5.26 -8.53 -1.05 0
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229699 87568519 1 O3S3N9C28H45 A3B3C9D28E45 -100.6 3.52 -8.72 -0.57 0
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229700 87568520 1 S2Cl4N4O5H14C23 A2B4C4D5E14F23 -84.24 5.55 -9.16 -2.3 0
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229701 87568556 2 OC7H14 AB7C14 -151.71 1.94 -10.57 0.9 0
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229702 87568557 1 MoNO4C10H11 ABC4D10E11 -33.98 2.83 -7.39 0.04 0
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229703 87568558 1 N2O5C23H24 A2B5C23D24 -76.31 7.72 -8.51 -0.94 0
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229704 87568562 1 SO5C15H22 AB5C15D22 -205.3 5.98 -9.39 0.01 0
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229705 87568565 1 SiO3C7H13 AB3C7D13 -73.5 0.9 0.0 0.0 0
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229706 87568569 1 NO2C24H31 AB2C24D31 -1.95 8.75 -8.81 -0.38 0
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229707 87568580 1 ClN3O8C21H26 AB3C8D21E26 -255.23 43.61 -6.99 -2.45 0
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229708 87568593 1 FNSO5C10H18 ABCD5E10F18 -279.44 1.54 -10.04 -0.34 0
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229709 87568594 1 O4C19H36 A4B19C36 -247.98 1.31 -10.66 0.39 0
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229710 87568601 1 NO6C20H31 AB6C20D31 -246.9 3.88 -8.1 -0.23 0
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229711 87568606 1 SF3O4N7C23H26 AB3C4D7E23F26 -168.34 8.34 -8.94 -0.88 0
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229712 87568611 2 SN2C7H7 AB2C7D7 94.04 5.72 -8.23 -0.98 0
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229713 87568614 1 FNO6C28H30 ABC6D28E30 -216.48 4.89 -8.79 -0.47 0
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229714 87568621 1 N2O4H18C19 A2B4C18D19 -104.91 5.43 -8.52 -0.6 0
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229715 87568624 1 NO5H15C16 AB5C15D16 -148.67 4.14 -8.76 -0.46 0
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229716 87568625 1 SN2O5H22C24 AB2C5D22E24 -102.54 2.74 -8.88 -0.78 0
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229717 87568626 1 MnN2O8C10H16 AB2C8D10E16 -291.9 7.9 0.0 0.0 0
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229718 87568637 1 NO4C17H17 AB4C17D17 -110.93 4.7 -8.29 -0.92 0
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229719 87568641 1 FSN2O3C25H29 ABC2D3E25F29 -92.06 3.27 -8.72 -0.25 0
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229720 87568643 1 FSO3N5C24H30 ABC3D5E24F30 -40.19 5.05 -8.99 -0.42 0
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229721 87568646 1 O4C21H40 A4B21C40 -262.82 2.73 -10.64 0.73 0
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229722 87568660 1 N3O6C28H31 A3B6C28D31 -127.5 5.35 -8.81 -0.76 0
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229723 87568665 1 BrPF2N2O4C25H30 ABC2D2E4F25G30 -302.43 3.3 -8.44 -0.53 0
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229724 87568666 1 BrPF2N2O4C25H30 ABC2D2E4F25G30 -307.87 4.96 -8.47 -0.58 0
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229725 87568671 1 NO2C16H27 AB2C16D27 -109.63 3.72 -9.65 0.48 0
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229727 87568673 2 NSiCl3H19C21 ABC3D19E21 -123.0 0.69 -8.02 -0.64 0
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229728 87568676 1 NO5C22H33 AB5C22D33 -242.19 4.75 -8.85 -0.35 0
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229729 87568679 1 NO6C28H31 AB6C28D31 -169.58 4.13 -8.35 -0.54 0
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229730 87568685 1 O4C27H52 A4B27C52 -291.56 2.31 -10.74 0.37 0
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229731 87568687 2 O2C10H19 A2B10C19 -240.97 6.46 -10.7 0.03 0
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229732 87568691 2 O2C11H21 A2B11C21 -271.0 0.74 -10.65 0.55 0
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229733 87568696 1 FS2N4O6C24H27 AB2C4D6E24F27 -226.26 1.3 -9.31 -1.34 0
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229734 87568711 1 NO3F7C12H12 AB3C7D12E12 -460.27 8.53 -8.28 -0.49 0
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229735 87568712 1 FSO3N7H16C17 ABC3D7E16F17 -33.04 5.8 -8.99 -1.2 0
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229736 87568733 1 CNSiO3H7 ABCD3E7 -204.72 2.11 -9.37 -1.69 0
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229737 87568736 1 FSO2N6C19H19 ABC2D6E19F19 -14.99 6.86 -9.12 -1.07 0
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229738 87568743 1 SN4O5C24H24 AB4C5D24E24 -99.98 5.66 -8.93 -1.04 0
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229739 87568746 1 N2O13C23H38 A2B13C23D38 -436.18 7.26 -9.66 -1.04 0
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229740 87568751 1 C2O3N5H7 A2B3C5D7 -28.76 4.31 -9.88 -0.93 0
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229741 87568752 1 SO7C19H26 AB7C19D26 -285.26 4.56 -9.68 -0.06 0
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229742 87568756 1 P3C4H13O13 A3B4C13D13 -766.9 3.21 -10.97 -0.19 0
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229743 87568757 1 BFN3O6C22H33 ABC3D6E22F33 -357.51 5.12 -8.58 -0.3 0
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229744 87568759 1 KN2O2S2C3H7 AB2C2D2E3F7 -135.56 9.37 -8.0 -0.06 0
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229745 87568766 1 FN3O3C22H22 AB3C3D22E22 -54.52 3.36 -9.39 -1.26 0
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229746 87568768 1 O4C23H42 A4B23C42 -255.57 8.56 -9.8 0.46 0
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229747 87568786 1 LiSH2C5O5F8 ABC2D5E5F8 -629.53 7.23 0.0 0.0 0
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229748 87568787 1 SO6C17H24 AB6C17D24 -255.83 5.52 -9.58 0.08 0
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229749 87568790 1 F2N3O4H23C27 A2B3C4D23E27 -122.47 5.67 -9.63 -1.19 0
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229750 87568791 1 SCl2F3N3O4H20C22 AB2C3D3E4F20G22 -276.03 3.67 -9.29 -1.22 0
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229751 87568792 1 S2N3O3C22H27 A2B3C3D22E27 -72.25 3.28 -9.0 -0.67 0
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229752 87568793 1 ClSN3O3F4C24H24 ABC3D3E4F24G24 -281.5 6.28 -9.05 -1.01 0