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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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180326 76616871 1 ClF3O7N8C43H56 AB3C7D8E43F56 -402.08 8.57 -8.61 -1.31 0
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180327 76616872 1 ClF3O7N8C44H56 AB3C7D8E44F56 -424.01 9.55 -8.96 -1.35 0
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180328 76616873 1 ClF3O7N8C41H54 AB3C7D8E41F54 -430.16 4.38 -8.76 -0.56 0
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180329 76616874 1 ClF3O7N8C44H60 AB3C7D8E44F60 -441.23 9.52 -8.73 -0.55 0
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180330 76616875 1 ClF3O6N7C40H53 AB3C6D7E40F53 -411.28 3.23 -8.82 -0.78 0
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180331 76616876 1 ClF3N6O7C37H46 AB3C6D7E37F46 -449.19 6.98 -8.65 -0.5 0
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180332 76616877 1 ClF3O6N7C41H55 AB3C6D7E41F55 -417.98 9.22 -8.63 -0.82 0
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180333 76616878 1 ClF3O6N8C43H58 AB3C6D8E43F58 -407.71 2.1 -8.73 -0.64 0
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180334 76617130 1 OF3N3H12C17 AB3C3D12E17 -109.32 5.13 -8.36 -1.57 0
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180335 76617131 1 F3N3O3C28H28 A3B3C3D28E28 -227.41 4.11 -8.27 -1.05 0
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180336 76617132 1 NO4C22H27 AB4C22D27 -148.83 4.0 -8.44 -0.03 0
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180337 76617133 1 O2N3C21H29 A2B3C21D29 -78.92 6.14 -9.23 -0.54 0
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180338 76617134 1 IO2C18H25 AB2C18D25 -82.26 3.49 -9.51 -0.83 0
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180339 76617135 1 OF3N5C23H24 AB3C5D23E24 -121.07 3.86 -8.27 -1.14 0
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180340 76617307 1 ClON2F4H13C19 ABC2D4E13F19 -176.33 6.25 -9.7 -1.35 0
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180341 76617358 1 BrSO5N6C27H31 ABC5D6E27F31 -121.52 8.0 -8.5 -0.99 0
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180342 76617359 1 SO4N6C35H40 AB4C6D35E40 -61.88 4.86 -7.93 -0.84 0
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180343 76617360 1 S2O3N4C22H22 A2B3C4D22E22 -43.71 3.44 -8.57 -0.99 0
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180344 76617868 1 O7N11C48H59 A7B11C48D59 -214.87 10.16 -8.44 -0.08 0
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180345 76617881 1 O5C23H26 A5B23C26 -145.28 2.41 -9.16 -0.16 0
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180346 76618201 1 N3O6C45H77 A3B6C45D77 -380.89 6.29 -8.94 0.74 0
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180347 76618202 1 N3O8C31H45 A3B8C31D45 -308.05 5.37 -8.72 -0.68 1
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180348 76618203 1 N3O8C31H46 A3B8C31D46 -287.6 10.89 0.0 0.0 0
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180349 76618885 1 F3O3N6C26H31 A3B3C6D26E31 -206.41 6.87 -8.82 -0.88 0
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180351 76620085 1 N11O12C38H71 A11B12C38D71 -608.25 4.16 -9.6 0.0 0