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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
83917 49862482 1 FON2H11C15 ABC2D11E15 -14.01 4.72 -8.89 -1.44 0
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83918 49862530 1 O2N3H9C13 A2B3C9D13 52.28 3.89 -9.69 -1.28 0
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83919 49862544 1 FON2H13C16 ABC2D13E16 -19.04 2.94 -9.09 -1.44 0
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83920 49862559 1 O2N7C28H33 A2B7C28D33 16.33 5.14 -8.85 -0.57 0
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83921 49862565 1 O2N3C23H33 A2B3C23D33 -69.13 7.12 -8.18 -0.01 0
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83922 49862567 1 ClNO3C20H30 ABC3D20E30 -71.91 10.47 -8.22 -0.6 1
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83923 49862570 1 NO3C19H28 AB3C19D28 -26.08 3.29 0.0 0.0 0
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83924 49862573 1 ClNOC8H14 ABCD8E14 -53.58 11.06 -8.65 -0.4 0
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83925 49862584 1 FO2N5C26H32 AB2C5D26E32 -83.64 3.07 -9.17 -1.2 0
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83926 49862585 1 FO2N5C22H26 AB2C5D22E26 -71.03 7.98 -9.16 -1.14 0
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83927 49862586 1 FO2N5C26H32 AB2C5D26E32 -80.6 4.48 -9.03 -1.22 0
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83928 49862594 1 O3N4C24H36 A3B4C24D36 -95.56 2.46 -9.36 -0.64 0
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83929 49862596 1 ClOF2N2H7C14 ABC2D2E7F14 -59.3 5.08 -9.44 -1.65 0
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83930 49862611 1 O4N5C27H33 A4B5C27D33 -117.19 6.53 -9.09 -0.89 0
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83931 49862614 1 O4N5C29H33 A4B5C29D33 -94.05 9.82 -9.21 -0.63 0
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83932 49862628 1 ClFSN2O2C20H24 ABCD2E2F20G24 -93.31 4.8 -8.78 -0.98 0
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83933 49862630 1 FSN2O2C20H25 ABC2D2E20F25 -81.3 6.6 -8.83 -0.77 0
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83934 49862631 1 FN3H10C12 AB3C10D12 28.85 1.51 -9.25 -0.92 0
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83935 49862648 1 O3N4C23H32 A3B4C23D32 -81.89 2.24 -9.47 -0.73 0
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83936 49862650 1 ClSN3O3C18H24 ABC3D3E18F24 -85.1 4.79 -9.35 -0.35 0
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83937 49862655 1 N3O5H11C13 A3B5C11D13 -15.55 2.31 -8.78 -2.0 0
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83938 49862656 1 BrN3O4H8C12 AB3C4D8E12 28.3 1.49 -9.51 -2.13 0
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83939 49862659 1 N3O6H11C13 A3B6C11D13 -44.89 2.0 -8.74 -2.15 0
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83940 49862703 1 ON2H20C23 AB2C20D23 44.92 2.43 -8.58 -0.67 0
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83941 49862706 1 O3F4N5C26H29 A3B4C5D26E29 -258.55 7.01 -9.28 -1.73 0