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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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62751 26736615 1 OCl2N3C18H20 AB2C3D18E20 19.07 24.09 0.0 0.0 0
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62752 26736624 1 OSN2C23H24 ABC2D23E24 30.73 4.21 -8.91 -0.74 1
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62753 26736627 1 ON4C26H31 AB4C26D31 66.0 3.26 0.0 0.0 0
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62754 26736628 1 ON4C26H30 AB4C26D30 37.47 4.05 -8.82 -0.59 1
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62755 26736631 1 N3O3C22H30 A3B3C22D30 -96.85 3.4 0.0 0.0 1
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62756 26736637 1 O3N4C24H25 A3B4C24D25 -19.11 13.51 0.0 0.0 0
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62757 26736638 1 O3N4C24H24 A3B4C24D24 -29.52 2.15 -9.01 -1.14 1
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62758 26736639 1 FON4C22H24 ABC4D22E24 0.79 2.09 0.0 0.0 1
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62759 26736643 1 ClOSN3C23H25 ABCD3E23F25 33.63 18.44 0.0 0.0 0
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62760 26736652 1 N3O5C22H27 A3B5C22D27 -86.12 7.98 -8.94 -1.32 1
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62761 26736654 1 O2N4C27H33 A2B4C27D33 -11.2 18.59 0.0 0.0 1
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62762 26736656 1 N3O5C22H28 A3B5C22D28 -90.19 7.75 0.0 0.0 0
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62763 26736657 1 N3O5C22H27 A3B5C22D27 -86.98 6.19 -8.81 -1.43 1
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62764 26736660 1 ClN2O2C21H24 AB2C2D21E24 -37.94 1.22 0.0 0.0 0
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62765 26736661 1 ClN2O2C21H23 AB2C2D21E23 -50.03 2.9 -8.93 -0.34 1
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62766 26736662 1 O3N4C24H29 A3B4C24D29 -67.24 14.75 0.0 0.0 0
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62767 26736671 1 FOSN3C22H22 ABCD3E22F22 -8.93 3.26 -8.91 -1.27 0
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62768 26736677 1 SO3N4C25H30 AB3C4D25E30 -69.57 7.65 -8.86 -0.88 1
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62769 26736682 1 OS2N3C21H24 AB2C3D21E24 52.28 17.91 0.0 0.0 0
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62770 26736691 2 OSN2C13H16 ABC2D13E16 -54.11 2.62 -8.68 -1.03 0
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62771 26736723 1 ClFON5H11C14 ABCD5E11F14 6.45 7.73 -9.07 -1.38 0
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62772 26736727 1 ClFSN2O2H12C17 ABCD2E2F12G17 -45.66 5.05 -9.04 -0.87 0
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62773 26736729 1 ClOSF2N2H9C16 ABCD2E2F9G16 -56.24 3.8 -9.1 -1.45 0
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62774 26736733 1 OCl3N3H14C16 AB3C3D14E16 6.21 4.75 -8.75 -1.15 0
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62775 26736734 1 ClON6C18H19 ABC6D18E19 61.23 7.84 -8.85 -1.11 0
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62776 26736736 1 ClON5C22H24 ABC5D22E24 47.78 4.68 -8.75 -0.55 0
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62777 26736747 1 ClSN3O3H20C22 ABC3D3E20F22 -42.64 7.55 -8.74 -1.4 0
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62778 26736752 1 ClFSN3O3C21H23 ABCD3E3F21G23 -119.35 5.46 -8.67 -1.07 0
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62779 26736757 1 ClOSN5H20C22 ABCD5E20F22 78.76 4.77 -8.78 -1.04 0
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62780 26736758 1 ClFON4H18C20 ABCD4E18F20 2.07 4.74 -8.99 -0.92 0
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62781 26736760 1 ClON3C20H24 ABC3D20E24 8.17 4.71 -8.57 -0.01 0
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62782 26736765 1 ClN4O4C20H23 AB4C4D20E23 -47.12 6.21 -8.84 -1.17 0
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62783 26736768 1 ClON3C20H20 ABC3D20E20 9.33 3.88 -8.66 -0.16 0
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62784 26736772 1 ClN3O5C20H22 AB3C5D20E22 -76.79 7.57 -8.61 -1.4 0
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62785 26736773 1 Cl2N2O2H18C19 A2B2C2D18E19 -42.5 4.56 -8.81 -0.32 0
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62786 26736774 1 Cl2N2O2H18C19 A2B2C2D18E19 -39.1 4.68 -8.98 -0.28 0
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62787 26736776 1 ClON4H25C26 ABC4D25E26 51.53 1.02 -8.92 -0.26 0
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62788 26736782 1 ClSO2N3H20C21 ABC2D3E20F21 7.74 3.7 -8.58 -0.82 0
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62789 26736786 1 OSCl2N3H17C20 ABC2D3E17F20 37.19 2.39 -8.82 -1.38 0
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62790 26736789 1 ClSO2N3H24C26 ABC2D3E24F26 26.07 4.5 -8.89 -0.91 0
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62791 26736813 1 ClOSN2H13C14 ABCD2E13F14 16.96 2.75 -9.49 -1.18 0
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62792 26736814 1 ClON3H16C19 ABC3D16E19 64.49 2.53 -8.98 -0.78 0
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62793 26736829 1 FNSO2C14H14 ABCD2E14F14 -74.54 4.13 -8.87 -1.09 0
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62794 26736840 1 ClON3H20C22 ABC3D20E22 68.21 5.32 -8.98 -0.67 0
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62795 26736854 1 ON2H18C19 AB2C18D19 40.17 6.53 -8.64 -0.31 0
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62796 26736871 1 ON2C16H18 AB2C16D18 8.14 3.41 -9.46 -0.97 0
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62797 26736875 1 OSCl2N3H11C16 ABC2D3E11F16 30.82 3.14 -9.11 -1.38 0
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62798 26736917 1 F2O2N3H17C19 A2B2C3D17E19 -69.37 9.34 -8.77 -0.8 0
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62799 26736922 1 SF2N2O3H16C17 AB2C2D3E16F17 -171.83 6.59 -9.29 -1.13 0
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62800 26736923 1 SF2N2O2H18C21 AB2C2D2E18F21 -96.16 8.1 -8.81 -1.1 0