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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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34600 7978713 1 ClN3O4C19H22 AB3C4D19E22 -134.85 6.49 -9.12 -0.81 0
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34601 7978715 1 ClN3O5C20H24 AB3C5D20E24 -186.03 5.65 -9.09 -0.72 0
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34602 7978716 1 ClN2O2C19H23 AB2C2D19E23 -83.33 2.18 -9.14 -0.39 0
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34603 7978718 1 N2O2C19H30 A2B2C19D30 -120.9 0.5 -9.04 0.36 0
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34604 7978719 1 ClO3N4C18H19 AB3C4D18E19 -62.05 8.61 -9.22 -0.9 0
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34605 7978720 1 N2O5C21H28 A2B5C21D28 -181.03 2.88 -8.88 -0.41 0
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34606 7978721 1 ClF3N3O3C18H19 AB3C3D3E18F19 -248.98 4.09 -9.41 -0.66 0
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34607 7978722 1 N2O3C23H30 A2B3C23D30 -130.56 3.71 -9.08 -0.05 0
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34608 7978725 1 ClN3O3C20H26 AB3C3D20E26 -81.41 4.77 -8.73 -0.06 0
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34609 7978728 1 ClN4O4C20H25 AB4C4D20E25 -133.7 6.67 -9.06 -0.83 0
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34610 7978730 1 ClN4O4C16H25 AB4C4D16E25 -181.02 4.15 -9.65 -0.27 0
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34611 7978731 1 N2O2F3C20H23 A2B2C3D20E23 -235.16 3.62 -9.14 -0.66 0
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34612 7978732 1 N2O5C23H32 A2B5C23D32 -191.13 3.18 -8.57 0.17 0
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34613 7978733 1 ClN4O4C19H23 AB4C4D19E23 -135.71 6.27 -9.78 -0.68 0
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34614 7978734 1 ClN2O2C20H23 AB2C2D20E23 -62.88 1.05 -9.28 -0.87 0
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34615 7978735 1 ClN4O4C19H23 AB4C4D19E23 -137.98 3.39 -9.76 -0.65 0
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34616 7978736 2 NO2C11H14 AB2C11D14 -137.65 3.81 -8.75 -0.58 0
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34617 7978737 1 ClN4O4C20H25 AB4C4D20E25 -141.53 6.45 -9.84 -0.49 0
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34618 7978740 1 N2O3C22H28 A2B3C22D28 -114.29 0.6 -8.84 0.17 0
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34619 7978742 1 SN3O3C20H23 AB3C3D20E23 -105.73 3.15 -8.94 -1.14 0
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34620 7978743 1 ClN4O5C17H19 AB4C5D17E19 -97.7 10.53 -9.7 -1.29 0
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34621 7978744 1 N3O4C24H29 A3B4C24D29 -100.49 2.89 -8.94 -0.4 0
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34622 7978745 1 ClN3O4C19H24 AB3C4D19E24 -130.46 3.13 -9.03 -0.25 0
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34623 7978746 1 N2O4C21H22 A2B4C21D22 -127.4 4.78 -8.91 -1.69 0
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34624 7978747 1 BrN2O2C19H23 AB2C2D19E23 -71.48 2.15 -9.11 -0.39 0