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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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219792 85164901 1 Si3O7C29H54 A3B7C29D54 -506.51 3.03 -9.76 -0.36 0
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219793 85164902 1 N2Si2O5C31H62 A2B2C5D31E62 -293.71 7.71 -8.63 1.31 0
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219794 85164903 1 ClSO2N4C34H35 ABC2D4E34F35 -9.16 4.08 -8.76 -0.4 0
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219795 85164904 1 ClSO2N4C34H35 ABC2D4E34F35 -6.65 2.3 -8.55 -0.55 0
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219796 85164905 1 PN5O9C26H42 AB5C9D26E42 -503.33 3.43 -9.59 -0.36 0
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219797 85164906 1 BrO4C34H47 AB4C34D47 -209.79 2.86 -9.44 -0.92 0
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219798 85164907 1 NO8C35H37 AB8C35D37 -283.95 3.84 -9.75 -0.82 0
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219799 85164908 1 N3O7C34H37 A3B7C34D37 -234.76 3.7 -8.71 -0.14 0
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219800 85164909 1 S3O5N7C25H25 A3B5C7D25E25 -27.25 6.03 -9.07 -1.09 0
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219801 85164910 1 O6N7C30H45 A6B7C30D45 -261.54 9.24 -9.06 -0.79 0
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219802 85164911 1 NSO8C32H41 ABC8D32E41 -269.94 6.38 -9.35 -0.46 0
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219803 85164912 1 SN3O5C33H49 AB3C5D33E49 -225.13 4.32 -8.44 0.22 0
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219804 85164913 2 SeO2C14H21 AB2C14D21 -167.31 2.88 -7.89 -1.89 0
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219805 85164914 1 O13C30H32 A13B30C32 -524.2 5.84 -9.26 -1.07 0
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219806 85164915 1 N6O9C28H36 A6B9C28D36 -195.51 4.01 -9.24 -0.11 0
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219807 85164916 2 PO2C18H21 AB2C18D21 -117.35 4.72 -8.5 -0.02 0
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219808 85164917 1 O9C34H48 A9B34C48 -372.71 4.91 -9.38 -0.35 0
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219809 85164918 1 N4O7C32H48 A4B7C32D48 -318.94 8.56 -8.86 0.09 0
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219810 85164919 2 O3C19H24 A3B19C24 -221.88 0.96 -9.33 0.18 0
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219811 85164920 4 OC10H14 AB10C14 -116.32 4.07 -8.27 -0.38 0
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219812 85164921 1 SiO4C38H52 AB4C38D52 -188.62 1.27 -9.08 0.01 0
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219813 85164922 1 PSNa2N5F6O7C15H16 ABC2D5E6F7G15H16 -757.47 4.55 -7.28 -0.96 0
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219814 85164923 1 SSeN2O7H26C27 ABC2D7E26F27 -205.16 7.7 -8.71 -0.71 0
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219815 85164924 1 NO14C27H39 AB14C27D39 -657.44 5.84 -9.76 0.35 0
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219816 85164926 1 SiN3O5C33H55 AB3C5D33E55 -232.83 3.93 -8.52 -0.02 0
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219817 85164927 1 O11C32H42 A11B32C42 -387.75 6.12 -8.71 -0.61 0
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219818 85164928 2 N2O3C17H21 A2B3C17D21 -232.4 10.1 -8.66 -1.18 0
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219819 85164929 2 N2O3C17H21 A2B3C17D21 -228.8 4.13 -9.32 -0.18 0
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219820 85164930 1 SiO6C36H46 AB6C36D46 -268.03 3.43 -9.07 -0.36 0
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219822 85164932 1 O3C41H62 A3B41C62 -145.57 2.05 -8.71 -0.16 0
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219823 85164933 1 SiO5C36H62 AB5C36D62 -361.14 5.1 -8.72 0.75 0
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219824 85164934 1 SiO3C39H58 AB3C39D58 -189.8 3.58 -9.19 -0.12 0
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219825 85164935 1 Cl2O8C31H32 A2B8C31D32 -275.39 3.3 -9.33 -0.3 0
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219826 85164936 1 S2O7N11C21H21 A2B7C11D21E21 -42.86 13.61 -8.61 -1.82 1
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219827 85164937 1 S2O7N11C21H22 A2B7C11D21E22 -53.15 11.64 0.0 0.0 0
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219828 85164938 1 NO9C33H49 AB9C33D49 -363.73 3.24 -10.12 -1.98 0
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219829 85164939 1 N5O7C31H49 A5B7C31D49 -340.77 7.17 -9.2 -0.76 0
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219830 85164940 1 BO6C38H41 AB6C38D41 -191.92 4.69 -8.99 -0.33 0
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219831 85164941 1 SN4O4F6C26H26 AB4C4D6E26F26 -354.86 4.45 -9.19 -0.92 0
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219832 85164942 4 NO2C8H9 AB2C8D9 -274.7 5.91 -9.12 -0.6 0
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219833 85164943 1 O11C32H44 A11B32C44 -496.18 5.84 -9.51 -0.67 0
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219834 85164944 1 PSiO11C27H45 ABC11D27E45 -580.53 1.78 -9.68 -0.2 0
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219835 85164945 1 O6C39H40 A6B39C40 -131.62 1.8 -8.89 -0.45 0
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219836 85164946 2 O2H18C21 A2B18C21 -1.37 2.25 -9.12 -0.67 0
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219837 85164947 1 FN2O3C39H41 AB2C3D39E41 -118.6 3.6 -8.33 -0.24 0
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219838 85164948 1 SiO8C33H52 AB8C33D52 -385.57 5.29 -8.09 0.11 0
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219839 85164949 1 SiO6C36H48 AB6C36D48 -252.76 1.11 -8.75 0.11 0
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219840 85164950 1 ClS2N6O8C22H29 AB2C6D8E22F29 -257.44 5.82 -9.6 -1.15 0
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219841 85164951 1 ClO2S2N4C32H33 AB2C2D4E32F33 -3.74 4.94 -8.38 -0.27 0
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219842 85164952 1 N5O6C33H43 A5B6C33D43 -244.52 8.73 -9.04 -0.5 1