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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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245650 99455797 1 N2O2C23H30 A2B2C23D30 -59.98 3.4 -9.02 -0.1 0
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245651 99455800 1 SO2N5C25H35 AB2C5D25E35 -38.87 3.19 -8.72 -0.91 0
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245652 99455801 1 SO2N5C25H35 AB2C5D25E35 -37.71 2.99 -8.93 -0.81 0
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245653 99455808 1 N2O3C21H28 A2B3C21D28 -106.36 3.08 -8.67 -0.52 0
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245654 99455810 1 N2O3C21H28 A2B3C21D28 -106.59 3.06 -8.68 -0.52 0
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245655 99455811 1 N3O3C24H35 A3B3C24D35 -120.75 6.27 -9.08 -0.15 0
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245656 99455812 1 N3O3C24H35 A3B3C24D35 -121.57 5.71 -9.19 -0.17 0
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245657 99455813 1 N3O3C24H35 A3B3C24D35 -121.03 5.93 -9.09 -0.16 0
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245658 99455814 1 N3O3C24H35 A3B3C24D35 -121.75 5.42 -9.17 -0.13 0
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245659 99455815 1 O2N3C22H33 A2B3C22D33 -89.21 2.34 -8.67 -0.44 0
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245660 99455819 1 Cl2N3O3C21H29 A2B3C3D21E29 -140.62 2.55 -8.95 -0.91 0
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245661 99455985 1 F2N3O4C24H27 A2B3C4D24E27 -225.86 7.58 -8.4 -0.66 0
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245662 99456552 1 NO4C22H27 AB4C22D27 -128.31 5.27 -8.42 0.06 0
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245663 99456570 1 SN4O4C26H32 AB4C4D26E32 -105.57 5.39 -8.2 -0.58 0
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245664 99494361 1 SN2F3O3H17C20 AB2C3D3E17F20 -212.56 4.41 -8.81 -0.84 0
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245665 99494460 1 O3N7H17C19 A3B7C17D19 7.64 11.46 -9.28 -1.03 0
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245666 99494611 4 NOH5C6 ABC5D6 -21.53 4.39 -8.79 -1.25 0
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245667 99494728 1 SN3O3C20H21 AB3C3D20E21 -93.31 3.97 -8.34 -1.03 0
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245668 99495445 1 F2N3O3H21C24 A2B3C3D21E24 -135.56 4.59 -9.0 -0.64 0
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245669 100053922 1 SN2O5C20H26 AB2C5D20E26 -171.36 3.42 -8.58 -0.24 0
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245670 100053923 1 SO2N3C15H19 AB2C3D15E19 -28.42 6.64 -9.2 -0.74 0
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245671 100053924 1 SN2O5C20H26 AB2C5D20E26 -172.82 4.49 -8.64 -0.3 0
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245672 100053925 1 FN2S2O4C20H25 AB2C2D4E20F25 -175.7 4.74 -8.82 -0.39 0
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245673 100053935 1 ClSN3O3C12H14 ABC3D3E12F14 -40.15 3.28 -9.83 -1.27 0
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245674 103022865 1 O2N3C11H21 A2B3C11D21 -81.18 4.45 -9.74 0.2 0
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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