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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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245675 103022867 1 O2N3C11H19 A2B3C11D19 -47.38 5.16 -9.76 0.11 0
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245676 103022869 1 O2N3C12H23 A2B3C12D23 -85.35 4.63 -9.63 0.3 0
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245677 103022871 1 O2N3C10H19 A2B3C10D19 -73.34 4.25 -9.79 0.15 0
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245678 103022876 1 O2N3C8H15 A2B3C8D15 -58.08 5.08 -9.77 0.29 0
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245679 103022897 1 ClO2N3C10H18 AB2C3D10E18 -67.34 5.3 -9.98 -0.31 0
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245680 103022899 1 ClON3C10H18 ABC3D10E18 -38.29 5.57 -9.82 -0.21 0
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245681 103022907 1 ClON3C10H18 ABC3D10E18 -35.63 5.28 -9.9 -0.24 0
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245682 103022910 1 ClON3C9H16 ABC3D9E16 -32.73 6.26 -9.66 -0.06 0
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245683 103022920 1 BrON3C11H20 ABC3D11E20 -29.23 6.69 -9.48 -0.61 0
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245684 103022930 1 ON2C12H20 AB2C12D20 -54.07 3.36 -8.28 1.23 0
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245685 103022938 1 ON2C12H20 AB2C12D20 -50.93 2.67 -8.4 1.14 0
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245686 103022941 1 ON2C14H24 AB2C14D24 -58.25 2.85 -8.48 1.04 0
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245687 103022945 1 N2O3C12H18 A2B3C12D18 -131.38 7.33 -9.08 0.54 0
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245688 103022946 1 N2O3C13H20 A2B3C13D20 -140.7 7.85 -8.93 0.66 0
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245689 103022949 1 ON3C12H21 AB3C12D21 -40.68 5.05 -8.45 1.08 0
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245690 103022950 1 ON3C13H23 AB3C13D23 -50.76 5.64 -8.35 1.14 0
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245691 103022951 1 ON3C11H19 AB3C11D19 -42.48 4.74 -8.67 0.91 0
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245692 103022960 1 ON4C10H20 AB4C10D20 -24.29 3.9 -9.65 0.38 0
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245693 103022963 1 ON4C12H24 AB4C12D24 -39.53 6.02 -9.43 0.4 0
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245694 103022967 1 ON4C11H22 AB4C11D22 -30.77 4.12 -9.54 0.41 0
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245695 103022970 1 ON4C8H16 AB4C8D16 -12.84 3.97 -9.72 0.39 0
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245696 103022972 1 ClSN3O3C7H12 ABC3D3E7F12 -97.29 10.89 -10.87 -0.9 0
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245697 103022976 1 ClSN3O4C10H18 ABC3D4E10F18 -141.67 9.46 -10.34 -1.06 0
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245698 103022982 1 ClSN3O3C8H14 ABC3D3E8F14 -96.26 9.52 -10.69 -1.12 0
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245699 103022997 1 SO3N4C10H18 AB3C4D10E18 -69.79 6.98 -10.23 -0.35 0