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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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293575 117393528 1 FO5C12H13 AB5C12D13 -227.72 3.15 -9.29 -0.53 0
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293576 117393597 1 F2O3C13H14 A2B3C13D14 -209.79 7.65 -9.03 -0.49 0
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293577 117393790 1 O2N4H12C13 A2B4C12D13 10.8 3.06 -8.56 -0.9 0
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293578 117393866 1 SO5C11H12 AB5C11D12 -175.22 6.54 -9.37 -0.89 0
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293579 117393869 1 SO5C11H12 AB5C11D12 -154.25 6.44 -9.34 -0.98 0
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293580 117393872 1 N2F3C13H15 A2B3C13D15 -136.4 3.31 -8.95 -0.59 0
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293581 117393874 1 N2F3C13H15 A2B3C13D15 -137.18 1.29 -8.91 -0.55 0
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293582 117393890 1 FO4C13H17 AB4C13D17 -201.94 4.09 -8.85 -0.03 0
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293583 117393916 1 FO4C13H17 AB4C13D17 -212.11 4.04 -9.23 -0.42 0
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293584 117393918 1 FO4C13H17 AB4C13D17 -208.03 1.69 -9.1 -0.45 0
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293585 117393933 1 FO4C13H17 AB4C13D17 -214.28 4.55 -9.19 -0.43 0
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293586 117393938 1 FO4C13H17 AB4C13D17 -201.31 5.51 -9.19 -0.4 0
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293587 117393940 1 FO4C13H17 AB4C13D17 -214.93 4.23 -9.45 -0.41 0
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293588 117393944 1 FO4C13H17 AB4C13D17 -207.4 4.46 -8.78 -0.56 0
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293589 117393945 1 FO4C13H17 AB4C13D17 -204.29 6.09 -8.75 -0.3 0
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293590 117393950 1 FO4C13H17 AB4C13D17 -202.8 3.89 -9.0 -0.12 0
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293591 117393955 1 FO4C13H17 AB4C13D17 -204.25 7.0 -9.06 -0.29 0
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293592 117393960 1 FO4C13H17 AB4C13D17 -209.03 3.6 -8.99 -0.2 0
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293593 117393998 1 FO4C13H17 AB4C13D17 -190.2 3.12 -8.4 -0.05 0
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293594 117394000 1 FO4C13H17 AB4C13D17 -176.62 4.01 -8.5 -0.12 0
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293595 117394001 1 FO4C13H17 AB4C13D17 -176.95 5.83 -8.53 -0.23 0
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293596 117394004 1 FN2O3C12H17 AB2C3D12E17 -151.33 1.26 -8.96 -0.13 0
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293597 117394010 1 SN2O4C10H12 AB2C4D10E12 -114.17 2.13 -9.21 -0.99 0
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293598 117394014 1 FSO3C12H13 ABC3D12E13 -142.18 1.89 -9.14 -0.87 0
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293599 117394071 1 OF2N2C13H18 AB2C2D13E18 -106.46 1.61 -8.79 -0.16 0
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293600 117394087 1 OF2N2C13H18 AB2C2D13E18 -114.94 3.91 -8.62 0.03 0
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293601 117394145 1 N2O2C15H16 A2B2C15D16 -20.5 5.67 -9.02 -0.81 0
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293602 117394180 1 N2O2C15H16 A2B2C15D16 -37.65 9.78 -9.36 -0.41 0
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293603 117394182 1 N2O2C15H16 A2B2C15D16 -19.94 8.28 -9.72 -0.46 0
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293604 117394185 1 N2O2C15H16 A2B2C15D16 -23.28 3.6 -9.68 -0.76 0
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293605 117394187 1 N2O2C15H16 A2B2C15D16 -40.97 4.71 -9.0 -0.47 0
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293606 117394206 1 N2O2C15H16 A2B2C15D16 -44.72 3.99 -8.73 -0.16 0
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293607 117394248 1 ON4C14H16 AB4C14D16 40.92 3.24 -7.9 0.24 0
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293608 117394249 1 ON4C14H16 AB4C14D16 43.54 4.72 -7.78 0.2 0
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293609 117394258 1 ON4C14H16 AB4C14D16 44.19 4.16 -8.54 -0.35 0
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293610 117394283 1 FO3C14H21 AB3C14D21 -187.4 5.11 -8.86 -0.1 0
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293611 117394347 1 SO4C12H16 AB4C12D16 -148.19 5.03 -8.3 -0.34 0
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293612 117394405 1 SO4C12H16 AB4C12D16 -152.6 3.99 -8.78 -0.46 0
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293613 117394406 1 SO4C12H16 AB4C12D16 -161.23 7.15 -8.76 -0.48 0
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293614 117394416 1 SN2O3C11H16 AB2C3D11E16 -94.44 2.99 -8.94 -0.41 0
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293615 117394431 1 FSO2C13H17 ABC2D13E17 -109.26 2.91 -9.01 -0.68 0
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293616 117394432 1 O2C17H20 A2B17C20 -55.26 3.28 -8.63 -0.15 0
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293617 117394489 1 ON2C16H20 AB2C16D20 -12.4 1.47 -8.81 -0.5 0
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293618 117394508 1 ON2C16H20 AB2C16D20 1.57 3.92 -9.04 -0.09 0
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293619 117394522 1 ON2C16H20 AB2C16D20 9.36 2.39 -8.71 -0.19 0
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293620 117394527 1 ON2C16H20 AB2C16D20 9.07 0.25 -8.49 -0.55 0
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293621 117394534 1 ON2C16H20 AB2C16D20 -1.6 4.91 -9.02 -0.07 0
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293622 117394546 1 ON2C16H20 AB2C16D20 -1.52 1.34 -8.46 -0.49 0
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293623 117394584 1 N4C15H20 A4B15C20 64.19 1.8 -8.9 -0.23 0
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293624 117394585 1 N4C15H20 A4B15C20 62.59 1.13 -8.95 -0.51 0
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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