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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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186927 77506468 1 BrNS2O5H18C21 ABC2D5E18F21 -122.94 4.19 -9.38 -1.33 0
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186928 77506499 1 ClFSN6O8C29H34 ABCD6E8F29G34 -335.56 5.18 -9.12 -1.26 0
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186929 77506500 1 O3N5C8H9 A3B5C8D9 -23.04 2.44 -9.98 -1.55 0
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186930 77506501 1 O3N5C8H9 A3B5C8D9 -33.59 7.42 -10.08 -1.48 0
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186931 77506583 1 FSCl2N5O9C29H34 ABC2D5E9F29G34 -422.37 9.23 -9.6 -1.34 0
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186932 77506905 1 N2O3C18H22 A2B3C18D22 -85.56 8.66 -9.49 -0.33 0
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186933 77506957 1 SO3N4C24H42 AB3C4D24E42 -172.89 5.25 -8.43 -0.7 0
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186934 77506967 1 O4N7C28H33 A4B7C28D33 -79.33 2.18 -8.79 -0.86 0
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186935 77507036 1 Br2N2O5C18H18 A2B2C5D18E18 -165.75 5.06 -10.23 -1.28 0
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186936 77507083 1 FN4O5H19C20 AB4C5D19E20 -152.34 8.14 -9.66 -2.05 0
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186937 77507123 1 Cl3N3O7C44H56 A3B3C7D44E56 -307.75 4.32 -8.95 -0.59 0
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186938 77507124 1 Cl3N3O6C40H48 A3B3C6D40E48 -247.41 6.37 -8.88 -0.73 0
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186939 77507125 2 F2N2O3H13C14 A2B2C3D13E14 -328.83 14.07 -8.96 -2.33 0
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186940 77507126 1 FN4O4H25C26 AB4C4D25E26 -85.09 3.45 -8.99 -1.97 0
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186941 77507127 1 ON3C10H15 AB3C10D15 -10.47 0.37 -8.62 0.02 0
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186942 77507128 2 NO2C8H8 AB2C8D8 -131.96 2.2 -8.25 -0.12 0
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186943 77507738 1 SF2N2O5C27H28 AB2C2D5E27F28 -251.07 7.5 -9.05 -0.84 0
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186944 77508021 1 N4O5C29H44 A4B5C29D44 -205.51 2.55 -8.27 -0.08 0
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186945 77508144 1 N3O5C29H41 A3B5C29D41 -185.94 4.2 -8.75 -0.2 0
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186946 77508145 1 SCl2O3N6C24H28 AB2C3D6E24F28 -72.79 5.09 -8.96 -1.97 0
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186947 77508155 1 O4N5C27H41 A4B5C27D41 -164.01 5.89 -8.44 -0.26 1
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186948 77508156 1 ClO3N4C20H24 AB3C4D20E24 -57.26 4.49 0.0 0.0 0
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186949 77508157 1 SN4O4C29H42 AB4C4D29E42 -150.17 1.88 -8.33 0.04 0
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186950 77508158 1 N4O5C25H36 A4B5C25D36 -204.93 6.89 -8.49 -0.36 0
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186951 77508159 1 ClO3F4N5C21H30 AB3C4D5E21F30 -376.82 3.38 -9.84 -1.43 0