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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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377622 134223685 1 ON2H34C51 AB2C34D51 178.48 4.85 -8.14 -0.86 0
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377623 134223686 1 NO3C16H27 AB3C16D27 -168.12 3.89 -9.81 0.93 0
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377624 134223688 1 ON2H34C51 AB2C34D51 174.41 1.17 -8.04 -0.7 0
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377625 134223689 1 NO3C19H33 AB3C19D33 -185.7 4.54 -9.66 0.78 0
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377626 134223690 1 SO3N4H54C96 AB3C4D54E96 353.63 4.25 -7.99 -0.91 0
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377627 134223691 1 ON4H44C67 AB4C44D67 266.74 1.17 -8.09 -1.1 0
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377628 134223692 1 O2N5H25C51 A2B5C25D51 261.68 6.41 -8.51 -1.62 0
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377629 134223693 1 ON4H44C67 AB4C44D67 266.14 3.12 -7.99 -0.93 0
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377630 134223694 1 ON4H44C67 AB4C44D67 265.71 2.01 -8.08 -1.03 0
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377631 134223695 1 ON5H43C66 AB5C43D66 278.96 0.59 -8.12 -1.25 0
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377632 134223696 2 ON3H12C26 AB3C12D26 292.56 4.52 -8.76 -1.63 0
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377633 134223697 1 ON4H40C61 AB4C40D61 244.33 2.85 -8.04 -0.94 0
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377634 134223698 1 ON5H43C66 AB5C43D66 279.85 2.77 -8.05 -1.29 0
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377635 134223699 2 ON2H17C29 AB2C17D29 229.69 3.17 -8.23 -0.94 0
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377636 134223700 2 ON2H17C29 AB2C17D29 229.77 3.51 -8.25 -0.95 0
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377637 134223701 1 ON5H43C66 AB5C43D66 279.28 3.36 -7.96 -1.3 0
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377638 134223702 1 O2N5H37C63 A2B5C37D63 265.09 2.77 -8.26 -1.32 0
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377639 134223703 2 ON2H19C32 AB2C19D32 251.42 3.26 -8.2 -0.95 0
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377640 134223704 1 O2N5H37C63 A2B5C37D63 265.98 1.6 -8.17 -1.24 0
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377641 134223705 1 ON4H40C61 AB4C40D61 242.86 1.4 -8.15 -0.93 0
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377642 134223706 1 ON4H40C61 AB4C40D61 243.72 3.95 -8.1 -0.87 0
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377643 134223707 1 ON4H40C61 AB4C40D61 243.97 3.04 -8.18 -0.88 0
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377644 134223708 1 ON2H38C57 AB2C38D57 195.29 1.82 -8.02 -0.58 0
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377645 134223709 1 ON2H42C67 AB2C42D67 248.45 1.56 -8.04 -1.1 0
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377646 134223710 1 O2N5H37C63 A2B5C37D63 266.07 2.43 -8.25 -1.28 0
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377647 134223711 1 ON2H38C57 AB2C38D57 197.64 1.75 -7.98 -0.56 0
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377648 134223712 1 O2N5H65C105 A2B5C65D105 397.37 6.53 -7.93 -0.67 0
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377649 134223713 1 O2N5H65C105 A2B5C65D105 398.63 1.2 -7.79 -0.74 0
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377650 134223714 1 SO3N4H54C96 AB3C4D54E96 351.33 3.79 -8.06 -0.72 0
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377651 134223715 1 ON2H42C67 AB2C42D67 248.67 1.48 -8.07 -1.14 0
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377652 134223716 2 ON2H17C29 AB2C17D29 229.77 1.47 -8.13 -0.97 0
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377653 134223717 1 ON4H44C67 AB4C44D67 266.83 1.78 -8.05 -1.03 0
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377654 134223718 1 ON5H43C66 AB5C43D66 279.85 1.59 -8.05 -1.23 0
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377655 134223719 1 ON5H43C66 AB5C43D66 280.57 2.4 -8.07 -1.23 0
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377656 134223720 1 ON4H40C61 AB4C40D61 243.84 3.79 -7.97 -0.92 0
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377657 134223721 1 ON5H43C66 AB5C43D66 280.93 3.87 -8.0 -1.27 0
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377658 134223722 1 ON5H43C66 AB5C43D66 281.0 3.26 -8.0 -1.18 0
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377659 134223723 1 ON5H43C66 AB5C43D66 281.9 4.27 -7.99 -1.32 0
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377660 134223724 1 O2N5H37C63 A2B5C37D63 264.9 0.9 -8.15 -1.27 0
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377661 134223725 2 ON2H17C29 AB2C17D29 231.71 1.35 -8.08 -0.95 0
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377662 134223726 2 ON2H17C29 AB2C17D29 229.26 2.87 -8.16 -0.94 0
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377663 134223727 1 ON4H40C61 AB4C40D61 243.92 4.58 -8.14 -0.94 0
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377664 134223728 2 ON2H16C28 AB2C16D28 224.47 2.59 -8.16 -1.18 0
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377665 134223729 2 ON2H16C28 AB2C16D28 224.2 2.43 -8.2 -1.22 0
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377666 134223730 2 SN2H17C29 AB2C17D29 289.11 1.67 -8.06 -0.98 0
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377667 134223731 1 ON4H38C59 AB4C38D59 238.62 0.9 -8.01 -1.18 0
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377668 134223732 1 ON5H43C66 AB5C43D66 279.34 1.6 -8.05 -1.28 0
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377669 134223733 1 ON2H42C63 AB2C42D63 218.59 2.32 -8.01 -0.59 0
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377670 134223734 1 ON2H38C57 AB2C38D57 195.58 2.54 -7.98 -0.6 0
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377671 134223735 1 OC13H24 AB13C24 -96.75 3.62 -9.63 0.9 0