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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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80572 49835197 1 ClON7H20C22 ABC7D20E22 96.25 5.33 -8.5 -0.93 0
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80573 49835203 1 SF3N3O4H22C23 AB3C3D4E22F23 -218.43 3.36 -10.13 -1.49 0
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80574 49835209 1 O3N4C27H28 A3B4C27D28 -3.75 3.69 -7.99 -0.78 0
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80575 49835225 1 FN9H16C20 AB9C16D20 136.57 6.57 -8.36 -1.37 0
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80576 49835235 1 FOSN8C22H23 ABCD8E22F23 66.05 5.62 -8.77 -0.66 0
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80577 49835242 1 ClSN4O4C25H25 ABC4D4E25F25 -95.86 4.03 -8.59 -0.84 0
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80578 49835245 1 FSN3O3H24C25 ABC3D3E24F25 -98.81 4.16 -8.63 -0.97 0
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80579 49835254 1 F2Si2N3O5C39H47 A2B2C3D5E39F47 -336.73 5.82 -8.32 -0.48 0
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80580 49835255 2 NOH8C9 ABC8D9 -20.75 5.73 -8.65 -0.79 0
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80581 49835270 1 ON5H19C21 AB5C19D21 98.04 6.36 -8.48 -1.24 0
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80582 49835284 1 O3N9H23C24 A3B9C23D24 61.98 1.47 -8.34 -1.31 0
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80583 49835288 1 OS2N3C15H29 AB2C3D15E29 -64.73 1.56 -8.28 -0.95 0
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80584 49835304 1 BrN2O2C19H19 AB2C2D19E19 -25.88 1.88 -8.7 -0.98 0
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80585 49835305 1 N2O2C19H20 A2B2C19D20 -26.93 1.88 -8.49 -0.75 0
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80586 49835306 1 SN4O4C25H32 AB4C4D25E32 -114.15 8.82 -8.16 -0.59 0
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80587 49835320 1 SCl2N2O4C17H18 AB2C2D4E17F18 -109.61 4.63 -10.23 -1.2 0
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80588 49835323 1 SF3N4O4C22H23 AB3C4D4E22F23 -212.2 9.07 -9.56 -1.26 0
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80589 49835324 1 SF3N4O4C22H23 AB3C4D4E22F23 -211.77 9.11 -9.54 -1.12 0
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80590 49835330 1 ClON3H16C20 ABC3D16E20 75.28 3.0 -9.09 -1.21 0
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80591 49835339 1 ClS2N4O4H25C28 AB2C4D4E25F28 -57.11 11.78 -8.35 -1.62 0
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80592 49835342 1 BrS2N4O4H23C27 AB2C4D4E23F27 -42.09 9.82 -8.52 -1.77 0
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80593 49835347 1 ON11C20H21 AB11C20D21 138.72 8.84 -8.26 -1.15 0
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80594 49835348 1 ON10H22C24 AB10C22D24 131.24 11.44 -8.21 -1.07 0
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80595 49835349 2 N5C10H11 A5B10C11 145.79 6.42 -8.35 -1.14 0
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80596 49835365 1 SN4O5C25H26 AB4C5D25E26 -138.75 9.66 -8.93 -1.24 0
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80597 49835408 4 N2H4C5 A2B4C5 159.44 4.06 -8.1 -1.14 0
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80598 49835416 1 NO6C26H43 AB6C26D43 -341.88 8.6 -10.24 0.36 0
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80599 49835432 1 FON5C29H36 ABC5D29E36 -40.83 7.12 -8.08 -0.36 0
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80600 49835438 1 SF3N3O4C24H24 AB3C3D4E24F24 -229.5 6.1 -9.97 -1.36 0
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80601 49835440 1 SN3O3F4C23H25 AB3C3D4E23F25 -297.3 7.23 -9.3 -0.94 0
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80602 49835443 1 O2N7C22H25 A2B7C22D25 81.69 5.89 -9.6 -0.99 0
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80603 49835447 1 O2N6C23H26 A2B6C23D26 72.21 2.64 -9.46 -0.89 0
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80604 49835450 1 N2F3O4C21H25 A2B3C4D21E25 -337.39 2.15 -9.89 -0.93 0
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80605 49835469 1 O2N6H20C23 A2B6C20D23 37.69 2.18 -8.77 -1.16 0
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80606 49835472 2 ON4H13C14 AB4C13D14 85.92 1.3 -8.62 -0.96 0
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80607 49835480 1 SF3N4O4H21C22 AB3C4D4E21F22 -205.54 2.78 -10.44 -1.67 0
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80608 49835483 1 SN3F4O4H21C23 AB3C4D4E21F23 -262.93 7.68 -10.38 -1.59 0
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80609 49835489 1 O2N5C23H29 A2B5C23D29 15.75 3.75 -9.22 -0.76 0
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80610 49835495 1 NO4C25H33 AB4C25D33 -195.01 3.68 -9.56 -0.25 0
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80611 49835497 1 NO5C28H41 AB5C28D41 -252.24 3.23 -8.96 0.05 0
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80612 49835498 1 NO5C27H39 AB5C27D39 -231.13 5.26 -9.2 0.16 0
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80613 49835511 2 NO2H12C13 AB2C12D13 -85.23 4.68 -8.6 -0.96 0
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80614 49835518 1 SO3N6C24H24 AB3C6D24E24 3.06 2.92 -8.66 -1.06 0
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80615 49835519 1 SO3N6C25H26 AB3C6D25E26 -6.47 5.25 -8.65 -1.06 0
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80616 49835523 1 ClON5C24H28 ABC5D24E28 22.22 6.84 -8.38 -0.56 0
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80617 49835532 1 O2F3N5C6H12 A2B3C5D6E12 -212.9 3.55 -9.14 -0.26 0
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80618 49835543 1 ClF2O2N3C23H26 AB2C2D3E23F26 -151.04 2.98 -8.5 -0.82 0
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80619 49835563 1 FSN3O4C26H26 ABC3D4E26F26 -135.37 2.99 -8.59 -0.86 0
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80620 49835566 1 O2N6H24C25 A2B6C24D25 54.38 4.67 -8.62 -1.11 0
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80621 49835575 1 ClFO2N4C23H24 ABC2D4E23F24 -78.86 3.93 -8.76 -1.0 0
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80622 49835584 1 OF2N4H16C24 AB2C4D16E24 50.5 4.55 -9.52 -1.0 0
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80623 49835592 1 ClF2O3N4C23H25 AB2C3D4E23F25 -185.14 8.61 -8.81 -0.69 0
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80624 49835597 1 NO2C22H29 AB2C22D29 -102.97 2.75 -9.45 0.24 0
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80625 49835598 1 ClN4O4C21H25 AB4C4D21E25 -169.58 2.31 -9.19 -0.96 0
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80626 49835600 1 SO2N8H22C24 AB2C8D22E24 73.87 7.08 -7.8 -1.22 0
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80627 49835604 1 N11H15C17 A11B15C17 200.14 4.57 -8.13 -1.15 0
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80628 49835618 1 ClO2N7H22C23 AB2C7D22E23 46.63 2.87 -8.26 -0.86 0
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80629 49835622 1 ClO2N5C22H24 AB2C5D22E24 -13.15 7.53 -8.34 -0.81 0
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80630 49835625 1 ClON6C24H29 ABC6D24E29 28.45 10.61 -8.32 -0.75 0
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80631 49835627 1 ClSO3N4C22H29 ABC3D4E22F29 -67.29 6.04 -8.79 -0.38 0
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80632 49835629 1 ClSN2F3O4C18H18 ABC2D3E4F18G18 -263.43 5.51 -10.24 -1.04 0
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80633 49835630 1 ClSN2F3O4H22C24 ABC2D3E4F22G24 -241.52 6.25 -9.9 -1.03 0
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80634 49835647 1 N4O4C19H26 A4B4C19D26 -145.37 5.44 -9.93 -0.82 0
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80635 49835656 1 FON9C23H26 ABC9D23E26 68.19 3.21 -8.77 -0.49 0
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80636 49835671 1 ON10H18C22 AB10C18D22 175.65 1.04 -8.72 -1.23 0
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80637 49835672 1 O3N7H23C24 A3B7C23D24 0.41 5.33 -8.53 -1.1 0
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80638 49835687 1 O2N5C23H23 A2B5C23D23 65.07 4.71 -9.39 -0.79 0
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80639 49835691 1 OC4N4H8 AB4C4D8 13.95 5.33 -9.79 0.1 0
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80640 49835694 1 ClSN2O3H17C19 ABC2D3E17F19 6.37 7.74 -9.2 -1.06 0
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80641 49835702 1 BBrKOH3F6C7 ABCDE3F6G7 -512.2 9.31 -9.68 -0.42 0
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80642 49835713 1 FON9C23H26 ABC9D23E26 60.33 3.85 -8.82 -0.51 0
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80643 49835714 1 ClFN9C25H27 ABC9D25E27 79.27 0.61 -8.6 -0.73 0
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80644 49835715 1 FN9C22H28 AB9C22D28 79.66 1.57 -8.58 -0.23 0
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80645 49835721 1 SO3N4C27H36 AB3C4D27E36 -105.75 2.04 -8.04 -0.44 0
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80646 49835726 1 ClON7H20C22 ABC7D20E22 79.87 4.29 -8.53 -0.95 0
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80647 49835728 1 ClFSN3O5C19H21 ABCD3E5F19G21 -210.3 4.55 -9.58 -1.29 0
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80648 49835733 1 SCl2F2N2O4H20C23 AB2C2D2E4F20G23 -176.43 3.52 -10.06 -1.02 0
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80649 49835734 1 NPCl6O6H8C20 ABC6D6E8F20 -232.46 4.99 -9.46 -1.69 0
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80650 49835737 1 N3O3C21H23 A3B3C21D23 -28.82 3.96 -8.24 -0.44 0
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80651 49835740 2 FON2C10H11 ABC2D10E11 -71.7 4.06 -9.61 -1.04 0
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80652 49835741 2 FON2H9C11 ABC2D9E11 -22.13 4.71 -9.65 -1.03 0
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80653 49835743 1 OF2N5H21C23 AB2C5D21E23 18.43 4.75 -9.7 -0.92 0
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80654 49835748 1 ClSN2F3O3H16C20 ABC2D3E3F16G20 -151.21 11.74 -9.32 -1.31 0
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80655 49835750 1 SN3O5H17C19 AB3C5D17E19 14.35 10.28 -9.39 -1.6 0
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80656 49835751 1 BBrKF3H8C13 ABCD3E8F13 -282.48 9.22 -8.65 -0.52 0
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80657 49835771 1 BBrHKNSC3F3 ABCDEFG3H3 -301.16 11.85 -8.39 -0.2 0
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80658 49835780 1 FN9C23H30 AB9C23D30 64.5 3.51 -8.62 -0.22 0
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80659 49835789 1 NO7C13H25 AB7C13D25 -332.25 4.93 -9.83 0.88 0
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80660 49835791 1 NSO9C16H23 ABC9D16E23 -431.47 3.74 -9.47 -0.29 0
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80661 49835794 1 NSO5C13H23 ABC5D13E23 -215.95 4.37 -9.24 -0.43 0
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80662 49835795 2 N2O5C8H11 A2B5C8D11 -388.8 5.39 -10.11 -0.5 0
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80663 49835800 1 SN4O5C8H14 AB4C5D8E14 -155.68 1.91 -9.54 -0.56 0
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80664 49835805 1 NSO8C14H21 ABC8D14E21 -377.51 4.56 -9.3 -0.17 0
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80665 49835806 1 NO7C16H29 AB7C16D29 -349.95 3.93 -9.75 1.02 0
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80666 49835808 1 SN4O9C16H22 AB4C9D16E22 -345.19 5.98 -9.42 -0.44 -2
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80667 49835809 1 P2N6C17O17H24 A2B6C17D17E24 -742.01 10.79 -9.94 -2.58 0
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80668 49835824 1 SN3O6C25H31 AB3C6D25E31 -139.26 1.36 -9.43 -1.03 0
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80669 49835825 1 ON2C16H16 AB2C16D16 41.32 2.1 -8.52 -0.38 0
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80670 49835829 1 SN3O7C29H35 AB3C7D29E35 -211.53 11.09 -8.91 -0.8 0
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80671 49835834 1 N2O2H14C17 A2B2C14D17 7.28 3.86 -8.76 -0.56 0