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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
360388 127301033 1 OF3N6C17H17 AB3C6D17E17 -95.23 3.5 -9.41 -0.89 0
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360389 127301034 1 FON6C20H21 ABC6D20E21 31.34 7.46 -9.31 -1.0 0
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360390 127301035 1 SO3N5C18H25 AB3C5D18E25 -68.0 8.07 -9.58 -0.78 0
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360391 127301036 1 OSN5C19H25 ABC5D19E25 26.38 6.95 -8.7 -0.43 0
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360392 127301037 1 O2N5C21H27 A2B5C21D27 -30.64 3.66 -9.84 -0.62 0
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360393 127301038 1 OSN6C17H20 ABC6D17E20 51.96 5.76 -8.95 -0.76 0
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360394 127301039 2 ON2C11H14 AB2C11D14 -46.42 6.5 -9.21 0.24 0
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360395 127301040 1 SO4N5C17H25 AB4C5D17E25 -99.79 5.64 -9.38 -0.49 0
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360396 127301041 1 O3N5C19H21 A3B5C19D21 -70.09 6.49 -9.15 -0.83 0
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360397 127301042 1 SO2N5C20H25 AB2C5D20E25 -34.96 3.37 -8.73 -0.94 0
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360398 127301043 1 SO2N4C18H28 AB2C4D18E28 -74.36 4.55 -8.84 0.21 0
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360399 127301044 1 ON6C20H30 AB6C20D30 6.08 4.11 -8.83 0.71 0
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360400 127301045 1 SO3N4C17H28 AB3C4D17E28 -117.01 0.99 -9.09 0.4 0
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360401 127301046 1 O2N4C21H26 A2B4C21D26 -43.53 4.24 -9.02 -0.44 0
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360402 127301047 1 O2N3C22H27 A2B3C22D27 -45.55 2.68 -9.12 -0.38 0
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360403 127301048 1 O2N7C17H21 A2B7C17D21 10.18 6.01 -9.24 -0.46 0
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360404 127301049 3 NOC7H9 ABC7D9 -78.21 1.4 -9.03 -0.17 0
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360405 127301050 1 SO3N4C16H26 AB3C4D16E26 -101.67 6.25 -9.38 0.39 0
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360406 127301051 1 SO2N4C20H26 AB2C4D20E26 -35.38 5.92 -9.03 -0.1 0
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360407 127301052 1 O2N5C20H21 A2B5C20D21 1.07 5.86 -9.06 -1.34 0
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360408 127301053 1 ON4C22H26 AB4C22D26 9.33 2.77 -8.26 -0.24 0
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360409 127301054 1 ClON6C20H23 ABC6D20E23 66.34 5.01 -9.11 -1.06 0
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360410 127301055 1 O2N4C21H28 A2B4C21D28 -59.26 8.67 -8.87 -0.03 0
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360411 127301056 1 O2N6C21H28 A2B6C21D28 -6.55 7.94 -8.87 -1.02 0
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360412 127301057 1 O2N5C22H27 A2B5C22D27 36.78 7.21 -9.42 -1.13 0
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360413 127301058 1 ON6C21H26 AB6C21D26 48.28 2.91 -9.06 -0.48 0
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360414 127301059 1 ClO2N4C20H23 AB2C4D20E23 -41.43 4.29 -8.86 -0.35 0
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360415 127301060 1 O3N7C18H23 A3B7C18D23 -74.99 7.31 -9.25 -0.67 0
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360416 127301061 1 SO2N4C20H24 AB2C4D20E24 -36.25 3.71 -8.72 -0.56 0
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360417 127301062 1 O3N4C21H26 A3B4C21D26 -80.06 2.63 -8.96 -0.18 0
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360418 127301063 1 ON5C23H27 AB5C23D27 52.32 6.27 -8.89 -0.47 0
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360419 127301064 1 O2N3C23H23 A2B3C23D23 5.11 1.51 -8.85 -0.69 0
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360420 127301065 1 O3N5C20H29 A3B5C20D29 -117.55 4.16 -9.02 -0.09 0
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360421 127301066 1 SO3N4C19H24 AB3C4D19E24 -70.07 7.38 -8.81 -0.12 0
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360422 127301067 1 OSN4C20H22 ABC4D20E22 40.05 4.05 -8.88 -1.0 0
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360423 127301068 1 OSN4C20H22 ABC4D20E22 41.25 3.0 -8.98 -0.73 0
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360424 127301069 1 N3O3C20H25 A3B3C20D25 -85.05 2.95 -8.41 -0.38 0
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360425 127301070 1 ON4C22H26 AB4C22D26 9.23 3.25 -8.24 0.06 0
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360426 127301071 1 O2N4C23H34 A2B4C23D34 -95.01 2.36 -9.16 0.65 0
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360427 127301072 1 SO3N4C19H24 AB3C4D19E24 -46.81 6.72 -9.08 -0.84 0
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360428 127301073 1 ON5C23H27 AB5C23D27 51.46 7.0 -8.88 -0.6 0
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360429 127301074 1 O2N4C23H30 A2B4C23D30 -52.05 6.25 -8.98 -0.26 0
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360430 127301075 1 O2N4C23H30 A2B4C23D30 -53.97 3.73 -8.91 -0.14 0
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360431 127301076 1 O2N4C23H32 A2B4C23D32 -44.56 3.74 -9.05 -0.2 0
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360432 127301077 1 N3O3C22H29 A3B3C22D29 -78.55 2.75 -8.4 0.05 0
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360433 127301078 1 O2N4C23H30 A2B4C23D30 -49.76 2.14 -9.12 -0.24 0
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360434 127301079 1 O3N4C20H28 A3B4C20D28 -117.91 2.81 -9.06 -0.01 0
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360435 127301080 1 SO2N3C19H25 AB2C3D19E25 -52.98 5.28 -8.92 -0.63 0
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360436 127301081 1 O2N4C23H30 A2B4C23D30 -48.39 5.64 -9.1 0.43 0
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360437 127301082 1 OSN5C19H23 ABC5D19E23 35.7 3.35 -8.82 -0.64 0