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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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140663 52738682 1 O2N3C25H25 A2B3C25D25 26.94 3.23 -8.9 -0.86 1
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140664 52738683 1 ClN2O2C20H26 AB2C2D20E26 -52.27 5.08 0.0 0.0 0
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140665 52738698 1 F2N3O5C23H23 A2B3C5D23E23 -263.13 5.47 -9.23 -1.22 0
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140666 52738699 1 ClN2O4C23H25 AB2C4D23E25 -126.72 7.54 -9.18 -0.38 0
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140667 52739042 1 ClSN3O4C21H26 ABC3D4E21F26 -145.91 3.61 -9.62 -0.94 0
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140668 52739043 1 ClSN3O3C22H26 ABC3D3E22F26 -101.58 3.29 -8.81 -0.49 0
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140669 52739044 1 ClSN3O3C22H26 ABC3D3E22F26 -106.83 3.41 -8.68 -0.95 0
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140670 52739677 1 ClFO2N3C24H25 ABC2D3E24F25 -71.25 2.4 -9.11 -1.05 0
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140671 52739935 1 SN2O5C24H30 AB2C5D24E30 -164.12 4.38 -8.88 -0.64 0
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140672 52740383 1 SO2N7H21C22 AB2C7D21E22 57.25 3.02 -9.08 -0.63 0
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140673 52740447 1 SF2N2O4C20H22 AB2C2D4E20F22 -198.23 4.32 -9.4 -0.78 0
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140674 52740454 1 SF2N2O4C23H28 AB2C2D4E23F28 -235.7 4.72 -9.33 -0.63 0
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140675 52740455 1 SF2N2O5C20H22 AB2C2D5E20F22 -232.8 8.96 -9.52 -0.96 0
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140676 52740456 1 SF2N2O5C20H22 AB2C2D5E20F22 -230.92 5.95 -9.32 -0.88 0
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140677 52740457 1 F2N2O3C16H16 A2B2C3D16E16 -163.6 3.97 -9.08 -0.78 0
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140678 52740458 1 F2N2O3C16H16 A2B2C3D16E16 -168.88 6.66 -8.86 -0.98 0
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140679 52740459 1 ClSF2N2O4C20H23 ABC2D2E4F20G23 -225.74 7.58 -9.26 -1.17 0
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140680 52740635 1 FNO6C22H28 ABC6D22E28 -249.68 6.02 -8.78 -0.46 0
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140681 52740636 1 FN2O3H21C22 AB2C3D21E22 -92.66 2.68 -8.36 -0.6 0
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140682 52740757 1 ClFON3H19C21 ABCD3E19F21 -30.37 4.14 -9.41 -0.8 0
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140683 52740964 1 ClFN2O3H20C25 ABC2D3E20F25 -92.45 2.59 -8.88 -1.07 0
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140684 52741061 1 FSN3O3C24H32 ABC3D3E24F32 -120.98 20.53 -6.93 -0.9 0
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140685 52741062 1 FSN3O3C24H32 ABC3D3E24F32 -151.47 3.36 -8.77 -0.84 0
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140686 52741224 1 OS2N3C19H27 AB2C3D19E27 -22.01 4.94 -8.52 -1.06 1
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140687 52741225 1 OS2N3C19H28 AB2C3D19E28 -29.04 11.97 0.0 0.0 1
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140688 52741265 1 SN3O4C22H38 AB3C4D22E38 -155.57 7.72 0.0 0.0 1
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140689 52741297 1 SO2N3C24H34 AB2C3D24E34 -55.16 10.14 0.0 0.0 1
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140690 52741317 1 O2N4C25H33 A2B4C25D33 -18.81 6.31 0.0 0.0 1
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140691 52741321 1 SO2N4C24H37 AB2C4D24E37 -73.26 2.27 0.0 0.0 1
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140692 52741357 1 SO3N4C23H37 AB3C4D23E37 -119.93 7.8 0.0 0.0 0
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140693 52741358 1 SO3N4C23H36 AB3C4D23E36 -120.0 4.92 -8.42 -1.19 1
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140694 52741359 1 SO3N4C23H37 AB3C4D23E37 -91.17 3.44 0.0 0.0 0
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140695 52741589 1 SN2O3C24H26 AB2C3D24E26 -55.22 6.56 -9.01 -1.03 0
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140696 52741611 1 ClSN2O3C23H23 ABC2D3E23F23 -60.24 6.0 -9.03 -1.17 0
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140697 52741612 1 ClN2O4C24H27 AB2C4D24E27 -142.52 1.41 -8.54 -0.31 0
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140698 52741613 1 ClN2O4C24H27 AB2C4D24E27 -141.57 3.45 -8.3 -0.47 0
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140699 52741728 1 O4N5C24H33 A4B5C24D33 -132.89 1.93 -9.11 -0.57 0
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140700 52741909 1 N2O2C23H24 A2B2C23D24 -6.87 5.75 -8.94 -0.6 0
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140701 52742022 1 ClN2O5C25H27 AB2C5D25E27 -172.33 7.85 -9.01 -0.87 0
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140702 52742389 1 SO2N3C21H33 AB2C3D21E33 -103.29 5.87 -8.64 -0.28 0
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140703 52742422 1 ClSN2O4C24H29 ABC2D4E24F29 -145.94 8.43 -9.71 -0.76 0
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140704 52743209 1 FN2O2C23H23 AB2C2D23E23 -94.96 4.75 -8.97 -0.66 0
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140705 52743237 1 N2O4C25H32 A2B4C25D32 -175.53 1.46 -9.04 -0.61 0
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140706 52743382 1 NOCl2S2C13H15 ABC2D2E13F15 -45.41 2.62 -8.86 -0.72 0
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140707 52743383 1 SCl2N2O3C20H20 AB2C2D3E20F20 -98.3 5.77 -9.19 -0.77 0
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140708 52743539 1 N2O5C24H24 A2B5C24D24 -131.59 5.6 -8.44 -0.67 0
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140709 52743675 2 NOSC12H12 ABCD12E12 -9.43 4.43 -8.54 -0.72 0
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140710 52743950 1 N2O3C20H26 A2B3C20D26 -94.84 3.4 -8.86 0.0 0
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140711 52744475 1 FN2O2C24H31 AB2C2D24E31 -115.21 4.47 -8.25 0.04 0
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140712 52744925 1 SN4O5C21H28 AB4C5D21E28 -107.37 6.81 -9.38 -1.08 0