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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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293625 117394597 1 N4C15H20 A4B15C20 62.69 2.81 -8.61 0.36 0
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293626 117394611 1 N4C15H20 A4B15C20 52.07 4.47 -8.61 0.08 0
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293627 117394628 1 N4C15H20 A4B15C20 66.25 5.47 -8.8 -0.22 0
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293628 117394635 1 N4C15H20 A4B15C20 67.51 4.43 -9.25 -0.7 0
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293629 117394638 1 N4C15H20 A4B15C20 76.14 0.71 -9.22 -0.28 0
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293630 117394649 1 N4C15H20 A4B15C20 59.35 2.82 -8.42 0.24 0
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293631 117394651 1 N4C15H20 A4B15C20 60.03 2.54 -8.11 0.21 0
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293632 117394658 1 SO3C13H20 AB3C13D20 -119.61 2.36 -8.02 -0.09 0
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293633 117394660 1 SN2O2C12H20 AB2C2D12E20 -83.23 3.25 -8.81 0.16 0
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293634 117394664 1 SO3C13H20 AB3C13D20 -111.87 5.36 -8.18 -0.25 0
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293635 117394684 1 N2C17H24 A2B17C24 13.49 2.71 -8.94 -0.63 0
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293636 117394696 1 N2C17H24 A2B17C24 3.27 1.41 -7.86 0.39 0
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293637 117394697 1 N2C17H24 A2B17C24 32.39 2.35 -8.84 0.34 0
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293638 117394908 1 ClO4C12H13 AB4C12D13 -146.81 7.82 -8.99 -0.65 0
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293639 117394916 1 ClO4C12H13 AB4C12D13 -132.63 7.32 -9.01 -0.66 0
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293640 117394917 1 ClO4C12H13 AB4C12D13 -139.95 2.18 -8.83 -0.55 0
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293641 117394928 1 ClO4C12H13 AB4C12D13 -138.89 4.4 -9.21 -1.2 0
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293642 117394979 1 ClO4C12H13 AB4C12D13 -148.43 7.15 -9.15 -0.99 0
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293643 117394980 1 ClO4C12H13 AB4C12D13 -149.2 6.88 -9.1 -0.93 0
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293644 117394982 1 ClO4C12H13 AB4C12D13 -160.43 4.91 -9.04 -0.74 0
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293645 117395000 1 ClO4C12H13 AB4C12D13 -132.87 3.48 -8.58 -0.33 0
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293646 117395088 1 ClFO2C13H14 ABC2D13E14 -125.52 4.95 -9.89 -0.62 0
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293647 117395103 1 ClO3C13H17 AB3C13D17 -115.78 4.06 -8.96 -0.35 0
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293648 117395134 1 ClO3C13H17 AB3C13D17 -129.97 5.38 -8.9 -0.21 0
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293649 117395171 1 ClO3C13H17 AB3C13D17 -112.64 4.85 -8.44 -0.07 0