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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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37603 8022565 1 FSN2O5C15H19 ABC2D5E15F19 -247.75 5.56 -10.35 -1.29 -1
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37604 8022576 1 SN2O6C16H21 AB2C6D16E21 -178.37 12.53 0.0 0.0 0
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37605 8022577 1 SN2O6C16H22 AB2C6D16E22 -241.0 13.14 -9.81 -0.86 0
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37606 8022587 1 SN2O6C17H22 AB2C6D17E22 -238.89 0.63 -9.62 -1.17 -1
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37607 8022588 1 SN2O6C17H21 AB2C6D17E21 -182.22 1.66 0.0 0.0 -1
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37608 8022592 1 NSO5C14H16 ABC5D14E16 -162.53 5.25 0.0 0.0 0
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37609 8022593 1 NSO5C14H17 ABC5D14E17 -184.96 9.56 -10.19 -1.58 0
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37610 8022597 1 SN2O6C17H22 AB2C6D17E22 -236.75 8.86 -10.07 -1.62 0
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37611 8022601 1 SN2O6C19H26 AB2C6D19E26 -248.63 10.57 -9.83 -1.53 -1
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37612 8022602 1 SN2O5C15H19 AB2C5D15E19 -141.18 3.48 0.0 0.0 0
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37613 8022605 1 SN2O5C15H20 AB2C5D15E20 -192.52 12.41 -9.96 -1.08 -1
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37614 8022612 1 SN2O5C18H25 AB2C5D18E25 -193.49 6.79 0.0 0.0 -1
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37615 8022618 1 SN2O5C21H23 AB2C5D21E23 -139.89 9.09 0.0 0.0 0
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37616 8022619 1 SN2O5C21H24 AB2C5D21E24 -171.76 6.57 -9.74 -0.73 -1
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37617 8022639 1 SN2O6C18H19 AB2C6D18E19 -195.91 9.62 0.0 0.0 0
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37618 8022642 2 NO3H10C11 AB3C10D11 -185.64 8.25 -9.0 -0.98 -1
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37619 8022647 1 N2O6C19H19 A2B6C19D19 -187.17 7.19 0.0 0.0 0
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37620 8022653 1 ClN2O2S2C11H11 AB2C2D2E11F11 -45.16 4.36 -8.87 -0.65 0
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37621 8022661 2 NOSC6H7 ABCD6E7 -48.57 3.59 -8.79 -0.43 0
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37622 8022662 2 NOSC6H7 ABCD6E7 -47.82 5.08 -8.74 -0.17 0
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37623 8022666 1 N2S2O4C13H14 A2B2C4D13E14 -110.96 4.44 -8.8 -0.41 0
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37624 8022669 1 BrN2O2S2C11H11 AB2C2D2E11F11 -34.85 4.76 -8.97 -0.72 0
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37625 8022674 1 FN2O2S2C11H11 AB2C2D2E11F11 -83.61 2.02 -8.93 -0.69 0
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37626 8022678 2 NOSC7H9 ABCD7E9 -58.0 3.32 -8.8 -0.46 0
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37627 8022679 2 NSO2C6H6 ABC2D6E6 -101.64 3.92 -8.92 -0.6 0
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37628 8022683 1 ClN2S2O3C12H13 AB2C2D3E12F13 -86.37 5.95 -8.86 -0.69 0
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37629 8022685 1 ClN2S2O3C12H13 AB2C2D3E12F13 -86.4 6.12 -8.86 -0.7 0
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37630 8022696 1 BrClN2O2S2H10C11 ABC2D2E2F10G11 -41.33 3.82 -8.96 -1.0 0
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37631 8022697 1 BrClN2O2S2H10C11 ABC2D2E2F10G11 -42.84 4.01 -8.97 -1.01 0
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37632 8022699 1 Cl2N2O2S2H10C11 A2B2C2D2E10F11 -51.73 2.15 -9.0 -0.91 0
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37633 8022705 1 N2O2S2C11H12 A2B2C2D11E12 -37.58 4.73 -8.82 -0.33 0
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37634 8022708 1 N2S2O3C12H14 A2B2C3D12E14 -79.15 2.52 -8.72 -0.39 0
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37635 8022719 1 FN2O2S2C11H11 AB2C2D2E11F11 -86.92 2.03 -9.07 -0.8 0
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37636 8022724 1 F2N2O2S2H10C11 A2B2C2D2E10F11 -130.04 3.82 -9.01 -0.9 0
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37637 8022727 1 ClN2O2S2C11H11 AB2C2D2E11F11 -48.57 1.83 -9.08 -0.8 0
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37638 8022731 1 FN2O2S2C11H11 AB2C2D2E11F11 -85.17 3.32 -8.98 -0.61 0
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37639 8022732 1 FN2O2S2C11H11 AB2C2D2E11F11 -85.77 3.19 -9.04 -0.71 0
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37640 8022746 1 ClN2O2S2F3H10C12 AB2C2D2E3F10G12 -206.85 4.55 -9.14 -1.3 0
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37641 8022751 1 ClN2O2S2C11H11 AB2C2D2E11F11 -47.18 3.4 -8.99 -0.69 0
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37642 8022756 1 BrN2O2S2C13H15 AB2C2D2E13F15 -54.82 5.73 -8.85 -0.52 0
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37643 8022761 1 BrFN2O2S2H10C11 ABC2D2E2F10G11 -79.73 3.6 -8.99 -1.01 0
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37644 8022764 1 BrFN2O2S2H10C11 ABC2D2E2F10G11 -79.75 3.8 -9.04 -1.03 -1
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37645 8022767 1 ClO5H14C16 AB5C14D16 -160.05 1.9 0.0 0.0 0
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37646 8022781 2 NOC10H12 ABC10D12 -28.62 3.12 -8.39 0.05 0
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37647 8022787 1 N2O2C21H26 A2B2C21D26 -35.36 4.1 -8.33 0.09 0
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37648 8022793 1 ClN2H15C16 AB2C15D16 51.48 3.52 -8.53 -0.08 0
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37649 8022823 1 SN2O5C21H22 AB2C5D21E22 -137.97 3.18 -8.54 -1.21 -1
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37650 8022828 1 SN2O3C14H15 AB2C3D14E15 -39.65 2.63 0.0 0.0 -2
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37651 8022848 2 NO3H7C10 AB3C7D10 -15.26 4.75 -9.72 -4.37 -1
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37652 8022850 1 O2N5C22H24 A2B5C22D24 70.72 14.22 0.0 0.0 0
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37653 8022851 1 O2N5C22H25 A2B5C22D25 12.1 5.18 -9.1 -0.69 0
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37654 8022863 1 SN2O6H18C19 AB2C6D18E19 -171.97 2.76 -8.88 -1.13 0
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37655 8022866 1 N4O5C20H22 A4B5C20D22 -137.52 8.32 -8.94 -0.84 1
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37656 8022867 1 N4O4C16H23 A4B4C16D23 -98.18 3.07 0.0 0.0 -2
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37657 8022878 1 PO6H17C18 AB6C17D18 -182.39 2.04 -9.27 0.08 0
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37658 8022879 1 PO6C18H19 AB6C18D19 -279.67 2.87 -9.45 -0.15 0
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37659 8022885 4 OH4C5 AB4C5 -98.74 6.8 -9.34 -1.33 0
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37660 8022887 1 BrN3O4H14C16 AB3C4D14E16 -7.79 6.83 -9.29 -1.8 0
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37661 8022890 1 INO3H10C16 ABC3D10E16 12.8 1.76 -8.99 -1.9 0
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37662 8022891 1 BrN3O4H12C15 AB3C4D12E15 2.11 5.84 -9.66 -1.36 0
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37663 8022923 1 BrN3O3H18C19 AB3C3D18E19 -41.91 4.57 -8.28 -0.88 0
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37664 8022924 1 BrN3O3H18C19 AB3C3D18E19 -42.33 4.74 -8.26 -0.92 0
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37665 8022937 1 ClO2N3C18H18 AB2C3D18E18 -7.5 5.7 -8.82 -1.08 0
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37666 8022984 1 N3O4H19C20 A3B4C19D20 -89.21 5.37 -8.75 -1.24 0
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37667 8023000 1 NO4H17C18 AB4C17D18 -99.15 2.51 -8.6 -0.5 0
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37668 8023002 1 FN4O4C21H23 AB4C4D21E23 -81.63 1.97 -9.26 -1.81 0
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37669 8023006 1 O2N4C19H20 A2B4C19D20 23.9 7.05 -8.06 -1.4 0
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37670 8023009 1 N2O3C20H20 A2B3C20D20 -36.61 5.64 -8.06 -1.0 0
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37671 8023013 1 ON4C18H18 AB4C18D18 40.45 5.38 -8.08 -1.16 0
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37672 8023018 1 SN4H8C11 AB4C8D11 126.09 3.27 -9.47 -1.28 0
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37673 8023019 1 BrON3C14H20 ABC3D14E20 -16.45 7.5 -8.66 -0.02 0
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37674 8023021 1 O3N4C16H20 A3B4C16D20 -79.16 2.62 -9.39 -0.8 0
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37675 8023032 1 BrO4H11C14 AB4C11D14 -87.58 3.39 -9.92 -1.03 0
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37676 8023035 1 O7H18C19 A7B18C19 -218.39 6.74 -8.57 -0.61 0
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37677 8023055 1 SN3O5C20H21 AB3C5D20E21 -113.23 5.37 -9.2 -0.94 0