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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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293350 117385234 1 FN3O3C11H12 AB3C3D11E12 -68.96 2.41 -9.03 -0.51 0
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293351 117385242 1 FN3O3C11H12 AB3C3D11E12 -67.62 3.94 -8.82 -0.75 0
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293352 117385247 1 NF2O2C13H13 AB2C2D13E13 -153.07 6.51 -9.05 -0.66 0
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293353 117385259 1 NF2O2C13H13 AB2C2D13E13 -137.18 4.28 -9.39 -0.49 0
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293354 117385306 1 FNSO3H8C11 ABCD3E8F11 -75.41 6.35 -8.96 -1.42 0
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293355 117385320 1 OF2N3C12H13 AB2C3D12E13 -69.71 2.53 -9.01 -0.35 0
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293356 117385333 1 OF2N3C12H13 AB2C3D12E13 -67.84 2.64 -9.67 -0.94 0
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293357 117385339 1 OF2N3C12H13 AB2C3D12E13 -67.42 3.94 -9.73 -0.66 0
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293358 117385344 1 OF2N3C12H13 AB2C3D12E13 -65.78 1.58 -9.02 -0.34 0
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293359 117385352 1 OF2N3C12H13 AB2C3D12E13 -77.1 7.45 -9.03 -0.12 0
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293360 117385617 1 FNO3C13H16 ABC3D13E16 -144.1 2.54 -8.78 -0.5 0
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293361 117386056 1 N5C14H15 A5B14C15 92.41 4.42 -8.31 -0.1 0
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293362 117386092 1 FNO2C14H20 ABC2D14E20 -114.07 2.98 -8.87 -0.15 0
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293363 117386098 1 FNO2C14H20 ABC2D14E20 -123.28 5.53 -8.66 0.07 0
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293364 117386106 1 FNO2C14H20 ABC2D14E20 -110.31 3.63 -8.69 0.06 0
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293365 117386159 1 FNO2C14H20 ABC2D14E20 -133.5 1.39 -8.86 -0.15 0
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293366 117386226 1 FNO2C14H20 ABC2D14E20 -123.07 3.36 -8.71 0.04 0
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293367 117386285 1 FNO2C14H20 ABC2D14E20 -97.3 3.33 -8.74 0.04 0
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293368 117386327 1 FNO2C14H20 ABC2D14E20 -113.2 2.64 -8.46 -0.1 0
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293369 117386328 1 FNO2C14H20 ABC2D14E20 -124.36 5.32 -8.49 -0.02 0
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293370 117386330 1 FNO2C14H20 ABC2D14E20 -126.98 1.34 -8.69 -0.23 0
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293371 117386354 1 FNO2C14H20 ABC2D14E20 -112.44 1.78 -8.94 -0.2 0
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293372 117386406 1 FNO2C14H20 ABC2D14E20 -120.12 3.03 -8.72 -0.1 0
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293373 117386408 1 FNO2C14H20 ABC2D14E20 -119.15 3.49 -8.36 -0.04 0
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293374 117386418 1 FNO2C14H20 ABC2D14E20 -118.77 2.62 -8.35 -0.03 0
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293375 117386430 1 FNO2C14H20 ABC2D14E20 -114.16 1.32 -8.3 0.02 0
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293376 117386455 1 NSO3C12H15 ABC3D12E15 -73.45 6.67 -9.81 -0.87 0
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293377 117386464 1 NSO3C12H15 ABC3D12E15 -80.0 2.36 -8.4 -0.38 0
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293378 117386466 1 NSO3C12H15 ABC3D12E15 -71.0 3.85 -9.4 -0.57 0
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293379 117386467 1 NSO3C12H15 ABC3D12E15 -67.76 5.0 -9.63 -1.02 0
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293380 117386481 1 FON3C13H20 ABC3D13E20 -64.84 1.64 -8.61 -0.19 0
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293381 117386483 1 NF2C15H21 AB2C15D21 -104.26 1.98 -8.79 -0.18 0
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293382 117386494 1 NF2C15H21 AB2C15D21 -114.81 2.38 -8.99 0.14 0
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293383 117386500 1 NF2C15H21 AB2C15D21 -114.29 3.28 -9.02 0.17 0
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293384 117386523 1 NF2C15H21 AB2C15D21 -101.69 1.8 -9.38 -0.16 0
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293385 117386534 1 NF2C15H21 AB2C15D21 -111.07 2.64 -9.11 -0.02 0
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293386 117386560 1 NO3C14H23 AB3C14D23 -118.67 3.64 -8.57 0.16 0
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293387 117386640 1 NOC17H19 ABC17D19 19.82 0.67 -8.67 0.18 0
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293388 117386654 1 N3C16H19 A3B16C19 110.75 2.04 -8.43 -0.7 0
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293389 117386658 1 N3C16H19 A3B16C19 79.17 3.13 -8.99 -0.09 0
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293390 117386659 1 N3C16H19 A3B16C19 86.85 4.32 -8.74 -0.22 0
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293391 117386704 1 NSO2C13H19 ABC2D13E19 -57.75 5.1 -8.17 -0.13 0
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293392 117386763 1 NSO2C13H19 ABC2D13E19 -48.99 2.07 -8.57 0.19 0
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293393 117386792 1 NSO2C13H19 ABC2D13E19 -75.0 5.87 -8.93 -0.35 0
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293394 117386821 1 FNSC14H20 ABCD14E20 -46.69 2.15 -8.59 -0.3 0
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293395 117386857 1 NS2C13H19 AB2C13D19 18.79 1.35 -8.5 -0.36 0
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293396 117386868 1 BrClFOH7C8 ABCDE7F8 -83.2 3.02 -9.95 -0.85 0
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293397 117386870 1 BrClFOH7C8 ABCDE7F8 -83.59 2.88 -9.82 -0.84 0
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293398 117387001 1 ClNO3C12H12 ABC3D12E12 -97.99 2.26 -8.64 -1.06 0
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293399 117387071 1 ClO2N3C11H12 AB2C3D11E12 -30.64 4.08 -8.68 -0.43 0