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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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85825 49879598 1 FOSCl2N3C11H11 ABCD2E3F11G11 -21.65 3.32 0.0 0.0 -1
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85826 49879599 1 SCl2O2N3C15H16 AB2C2D3E15F16 14.53 4.15 0.0 0.0 -1
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85827 49879602 1 ClOSN3C12H15 ABCD3E12F15 26.38 5.69 0.0 0.0 -1
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85828 49879604 1 ClON4C17H22 ABC4D17E22 40.92 1.6 0.0 0.0 -1
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85829 49879611 1 ClN3C16H19 AB3C16D19 68.47 3.58 0.0 0.0 -1
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85830 49879612 1 ClOSN3C12H15 ABCD3E12F15 59.93 6.54 0.0 0.0 -1
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85831 49879616 1 ClON3C9H13 ABC3D9E13 19.01 2.93 0.0 0.0 -1
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85832 49879621 1 ClO2N4C23H24 AB2C4D23E24 2.05 0.83 0.0 0.0 -1
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85833 49879622 1 ClSO2N3C13H13 ABC2D3E13F13 -15.24 12.58 0.0 0.0 -1
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85834 49879661 1 ClN3C13H15 AB3C13D15 35.65 2.85 0.0 0.0 -1
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85835 49879664 1 ClN3C12H13 AB3C12D13 74.61 4.57 0.0 0.0 -1
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85836 49879667 1 ClSO2F3N3H14C15 ABC2D3E3F14G15 -166.0 4.19 0.0 0.0 -1
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85837 49879675 1 ClON2C19H24 ABC2D19E24 19.41 4.39 0.0 0.0 -1
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85838 49879678 1 ClN2O2C9H10 AB2C2D9E10 -25.0 4.04 0.0 0.0 -1
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85839 49879679 1 ClN2O2H16C18 AB2C2D16E18 5.39 1.3 0.0 0.0 -1
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85840 49879680 1 ClN2H16C17 AB2C16D17 91.25 4.44 0.0 0.0 0
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85841 49879681 1 N2S2O5H20C22 A2B2C5D20E22 -168.09 6.89 -8.99 -0.91 -1
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85842 49879682 1 ClN3H17C18 AB3C17D18 102.08 1.21 0.0 0.0 0
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85843 49879683 1 FN2S2O3H21C26 AB2C2D3E21F26 -103.29 6.89 -8.84 -0.64 -1
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85844 49879688 1 Cl3N3H9C14 A3B3C9D14 64.82 2.8 0.0 0.0 0
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85845 49879692 1 S2N3O3H25C27 A2B3C3D25E27 -47.95 4.94 -8.26 -0.51 -2
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85847 49879716 1 PN2O4H29C38 AB2C4D29E38 54.31 6.43 -7.99 -1.39 -1
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85848 49879720 1 BrN2C16H16 AB2C16D16 77.43 3.51 0.0 0.0 0
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85849 49879728 1 O2N5H19C21 A2B5C19D21 27.62 9.17 -8.0 -1.16 0
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85850 49879732 1 SCl2N4O5H16C24 AB2C4D5E16F24 -22.36 7.86 -8.89 -1.46 0