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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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389661 134994343 1 BrTeC10H13 ABC10D13 17.65 6.99 -8.01 -0.82 0
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389662 134994351 1 PSC6F6H13 ABC6D6E13 -467.85 14.75 -10.59 -1.12 0
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389663 134994352 1 FeO2P2Se2C10H24 AB2C2D2E10F24 -81.04 7.2 -7.81 -0.55 0
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389664 134994353 1 SeO2C9H16 AB2C9D16 -113.88 3.49 -8.32 0.26 0
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389665 134994356 1 TeC2I2F6 AB2C2D6 -298.98 1.96 -9.95 -3.47 0
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389666 134994368 1 NSO2C14H17 ABC2D14E17 -8.23 3.38 -9.39 0.31 0
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389667 134994372 1 NOSC13H25 ABCD13E25 -32.21 3.08 -8.29 0.57 0
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389668 134994373 1 BNO2F4C9H18 ABC2D4E9F18 -439.62 16.68 -11.71 -1.31 0
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389669 134994375 1 PSeC4H5F6 ABC4D5E6 -313.66 3.69 -9.56 -0.97 0
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389670 134994387 1 NO3C14H19 AB3C14D19 -108.77 2.79 -9.24 -0.33 0
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389671 134994392 1 SO3C9H18 AB3C9D18 -153.75 5.85 -11.08 -0.04 0
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389672 134994399 1 BiSe2Cl3C5H12 AB2C3D5E12 -66.62 4.31 -8.3 -2.27 0
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389673 134994408 1 NO3C15H23 AB3C15D23 -110.63 4.92 -9.74 0.0 0
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389674 134994409 1 ClNOSC10H12 ABCDE10F12 20.24 3.65 -9.19 -0.69 0
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389675 134994410 1 NO2C9H17 AB2C9D17 -48.44 4.34 -10.81 -0.36 0
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389676 134994411 1 NO2C8H11 AB2C8D11 9.78 4.45 -10.27 -0.42 0
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389677 134994419 1 ITeC7H17 ABC7D17 -14.83 9.05 -7.65 -0.58 0
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389678 134994420 1 Te2C11H24 A2B11C24 -30.53 0.94 -7.78 0.46 0
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389679 134994430 1 S2O3C8H16 A2B3C8D16 -148.1 2.32 -8.3 -0.69 0
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389680 134994436 1 NOC14H21 ABC14D21 -31.86 2.24 -8.53 0.35 0
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389681 134994437 1 ClNO2C8H10 ABC2D8E10 -98.03 3.85 -10.33 -0.63 0
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389682 134994438 1 NOSC12H15 ABCD12E15 -17.85 3.59 -9.43 -0.8 0
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389683 134994439 2 ON2C3H5 AB2C3D5 -55.43 5.43 -9.57 0.52 0
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389684 134994440 1 NC10H19 AB10C19 13.58 2.1 -8.91 1.24 0
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389685 134994441 1 NC10H21 AB10C21 -23.36 1.74 -9.15 1.06 0
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389686 134994443 1 SO3C9H16 AB3C9D16 -127.33 2.21 -9.21 -0.24 0
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389687 134994448 1 S2O3C12H14 A2B3C12D14 -48.54 3.2 -8.13 -0.07 0
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389688 134994451 1 TeO2Cl4C9H14 AB2C4D9E14 -177.88 4.07 -9.75 -2.52 0
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389689 134994453 1 NO5C12H17 AB5C12D17 -122.09 4.73 -9.66 -0.83 0
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389690 134994462 1 BrNOC10H18 ABCD10E18 -37.96 3.79 -9.18 -0.91 0
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389691 134994470 1 NO2C9H17 AB2C9D17 -61.73 4.52 -8.55 1.21 0
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389692 134994472 1 N2O5C9H10 A2B5C9D10 -67.85 4.6 -9.14 -0.63 0
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389693 134994486 1 OSC13H18 ABC13D18 -9.95 1.93 -9.1 -0.5 1
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389694 134994489 1 OSC6H13 ABC6D13 -58.87 0.97 0.0 0.0 0
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389695 134994496 1 OSC7H14 ABC7D14 -56.62 4.32 -8.13 1.06 0
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389696 134994497 1 NSC16H25 ABC16D25 -3.19 2.33 -8.4 0.14 0
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389697 134994500 1 ITeS2C7H15 ABC2D7E15 9.35 6.55 -7.92 -0.69 0
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389698 134994504 1 SN2O3C10H16 AB2C3D10E16 -80.62 4.13 -8.31 -0.78 0
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389699 134994512 1 NO4C12H15 AB4C12D15 -84.45 5.48 -9.97 -0.74 0
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389700 134994525 1 NOSC13H19 ABCD13E19 -10.11 6.26 -7.96 0.46 0
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389701 134994526 1 BrOSC10H21 ABCD10E21 -74.6 6.66 -8.27 0.13 0
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389702 134994541 1 NSC14H21 ABC14D21 24.43 5.68 -7.45 0.44 0
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389703 134994546 1 TeBr2C6H14 AB2C6D14 -39.81 6.21 -8.77 -1.89 0
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389704 134994547 1 BrTeC7H15 ABC7D15 -19.05 7.46 -7.82 -0.62 0
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389705 134994549 1 SC13H16 AB13C16 25.08 2.2 -8.9 -0.01 0
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389706 134994553 1 INO2C10H16 ABC2D10E16 -11.39 3.02 -9.86 -1.34 0
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389707 134994557 1 NC12H25 AB12C25 -36.94 1.17 -8.35 2.94 0
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389708 134994566 1 ClNSO3C9H14 ABCD3E9F14 -133.64 2.62 -9.01 -1.21 0
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389709 134994569 1 IOSC6H13 ABCD6E13 -35.05 5.19 -8.55 -0.86 0
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389710 134994570 1 NC13H17 AB13C17 52.32 1.98 -9.13 0.48 0
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389712 134994592 1 SN2O4C11H20 AB2C4D11E20 -110.92 4.98 -8.82 -0.56 0
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389713 134994599 1 NO3C9H15 AB3C9D15 -60.68 5.72 -10.34 -0.58 0
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389714 134994610 1 SC13H18 AB13C18 20.03 1.41 -8.62 0.37 0
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389715 134994612 1 NC12H25 AB12C25 -32.69 2.5 -9.13 1.59 0
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389716 134994616 1 NC14H25 AB14C25 -11.82 0.9 -8.67 1.17 0
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389717 134994622 1 SN2C9H12 AB2C9D12 74.2 2.66 -8.88 0.08 0
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389719 134994624 1 S2O4C7H10 A2B4C7D10 -183.39 8.06 -9.9 -2.01 0
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389720 134994711 1 ClN2O2C8H9 AB2C2D8E9 4.08 4.63 -10.39 -1.52 0
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389721 134994712 1 SN2C9H10 AB2C9D10 81.12 8.51 -8.1 0.02 0
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389722 134994718 1 OSCl4C7H10 ABC4D7E10 -72.18 3.51 -9.62 -1.34 0
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389723 134994730 1 PSSeC14H23 ABCD14E23 -10.17 5.37 -8.5 -0.61 0
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389724 134994740 1 SN2O2F3C10H11 AB2C2D3E10F11 -228.51 3.65 -9.31 -1.18 0
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389725 134994746 1 PS2O3C8H17 AB2C3D8E17 -227.01 3.8 -9.49 -0.76 0
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389726 134994747 1 PO2S2C12H23 AB2C2D12E23 -153.43 4.93 -9.08 -0.15 0
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389727 134994749 1 SiO3C13H22 AB3C13D22 -100.18 4.83 -8.58 0.5 0
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389728 134994769 1 OF2N5C9H13 AB2C5D9E13 -23.64 4.06 -9.98 -2.06 0
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389729 134994770 1 ON8C9H14 AB8C9D14 106.58 7.67 -9.03 -2.14 0
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389730 134994816 1 Li2N2H4O4C7 A2B2C4D4E7 -113.05 3.75 -9.56 -0.89 0
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389731 134994818 1 CrN2O5C9H10 AB2C5D9E10 -10.49 3.15 -7.48 0.19 0
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389732 134994823 1 N2Cl3O3H5C7 A2B3C3D5E7 -32.94 2.49 -9.45 -1.49 0
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389733 134994847 1 P3S3C7O11H17 A3B3C7D11E17 -716.12 4.12 -9.92 -1.05 0
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389734 134994859 1 O5N6C7H14 A5B6C7D14 16.93 3.33 -10.41 -1.76 0
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389735 134994860 1 BrON2C14H19 ABC2D14E19 2.99 3.3 -8.79 -0.44 0
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389736 134994861 1 SiN2F4C6H14 AB2C4D6E14 -67.69 5.01 -10.24 0.96 0
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389737 134994873 1 ClC13H17 AB13C17 2.17 2.17 -9.34 0.37 0