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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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192382 78263364 1 ClN2O6H16C25 AB2C6D16E25 -98.68 4.75 0.0 0.0 -1
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192383 78263365 1 Cl2N3O5H16C24 A2B3C5D16E24 -65.84 20.72 0.0 0.0 -1
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192384 78263366 1 NCl2S2O5H14C20 AB2C2D5E14F20 -89.36 4.59 0.0 0.0 1
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192385 78263367 1 NO2C20H26 AB2C20D26 -29.12 3.65 0.0 0.0 0
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192386 78263620 1 ClSO2N4C18H19 ABC2D4E18F19 -26.17 3.0 -8.82 -0.4 0
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192387 78263798 1 SN3O5H15C16 AB3C5D15E16 -121.58 2.87 -9.56 -1.99 1
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192388 78263799 1 N3O3C14H26 A3B3C14D26 -138.4 3.48 0.0 0.0 0
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192389 78263800 1 SN2O2C20H22 AB2C2D20E22 -5.06 5.6 -8.64 -1.74 -1
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192390 78263801 1 NO3C16H22 AB3C16D22 -126.54 4.38 0.0 0.0 0
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192391 78263802 1 N2F3O4C13H15 A2B3C4D13E15 -305.05 13.17 -9.06 -0.64 -1
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192392 78263803 1 SN2O4H19C23 AB2C4D19E23 -12.83 20.15 0.0 0.0 0
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192393 78263804 2 O2N3H11C13 A2B3C11D13 -25.82 7.05 -9.05 -1.36 0
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192394 78263805 1 O4N6C23H24 A4B6C23D24 -72.82 8.38 -9.05 -0.54 0
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192395 78263889 1 FN2O7H21C25 AB2C7D21E25 -169.92 5.5 -9.07 -1.4 0
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192396 78264011 1 SN2O2C17H24 AB2C2D17E24 -84.37 5.48 -8.41 0.05 0
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192397 78264336 1 BrClF2N2O2H10C16 ABC2D2E2F10G16 -78.33 3.52 -9.15 -0.89 1
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192398 78264402 1 NOSC13H22 ABCD13E22 -25.15 3.09 0.0 0.0 0
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192399 78264403 1 SO3N6H22C23 AB3C6D22E23 46.01 6.47 -8.85 -1.69 0
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192400 78264405 1 ClSO2N5C22H24 ABC2D5E22F24 13.82 4.04 -8.97 -1.26 1
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192401 78264648 1 ClN2O5C24H30 AB2C5D24E30 -177.5 9.2 0.0 0.0 0
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192402 78264996 1 N3O3H21C23 A3B3C21D23 1.51 5.4 -8.97 -0.74 -1
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192403 78265323 1 ClSO3N4H18C21 ABC3D4E18F21 14.06 8.55 0.0 0.0 -1
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192404 78265801 1 N2O9H19C24 A2B9C19D24 -238.3 3.94 0.0 0.0 1
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192405 78266485 1 OSN3C17H18 ABC3D17E18 40.36 9.2 0.0 0.0 2
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192406 78266557 2 NOC8H15 ABC8D15 -36.13 5.14 -8.88 0.19 0
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192407 78266705 1 N3O3C14H21 A3B3C14D21 -26.03 5.54 -8.77 -1.21 0
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192408 78266706 1 FSN3O3C18H20 ABC3D3E18F20 -136.23 8.7 -8.91 -0.6 0
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192409 78266707 1 N2O2H18C23 A2B2C18D23 58.72 3.39 -8.62 -0.96 1
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192410 78266708 1 Cl2N6C25H25 A2B6C25D25 135.85 3.46 0.0 0.0 0
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192411 78266709 1 BrON2H15C17 ABC2D15E17 43.67 2.19 -8.86 -0.82 0
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192412 78267065 1 BrON2C20H21 ABC2D20E21 30.99 3.48 -8.57 -0.25 0
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192413 78267066 1 SN3O4H23C27 AB3C4D23E27 -28.86 3.41 -9.25 -1.63 0
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192414 78267114 1 SN3O4H23C27 AB3C4D23E27 -29.89 2.19 -9.08 -1.39 1
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192415 78267138 1 FNO2C17H27 ABC2D17E27 -109.38 0.86 0.0 0.0 -1
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192416 78267338 1 FO3H12C19 AB3C12D19 -50.07 2.18 0.0 0.0 1
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192417 78267339 1 ClO2N7H23C27 AB2C7D23E27 143.08 38.0 0.0 0.0 0
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192418 78267340 1 ClO2N7H22C27 AB2C7D22E27 126.19 10.05 -8.59 -2.53 1
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192419 78267341 1 ClO2N7H19C21 AB2C7D19E21 75.97 11.58 0.0 0.0 0
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192420 78267342 1 ClO2N7H18C21 AB2C7D18E21 103.19 12.91 -8.8 -2.5 0
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192421 78267343 1 N3O4C25H33 A3B4C25D33 -48.03 5.13 -8.9 -1.4 0
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192422 78267344 1 ClSO2N5H12C18 ABC2D5E12F18 88.93 5.52 -9.08 -2.32 0
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192423 78267345 1 O2N6C19H28 A2B6C19D28 -44.93 5.14 -8.99 -0.35 0
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192424 78267346 1 SCl2O4N5H9C16 AB2C4D5E9F16 -4.41 7.86 -10.44 -2.48 0
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192425 78267347 1 ClSO4N5H10C17 ABC4D5E10F17 19.59 9.46 -10.2 -2.53 0
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192426 78267348 1 ClISO2N5H9C16 ABCD2E5F9G16 96.5 7.67 -9.05 -2.99 1
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192427 78267856 1 SO5N7H14C16 AB5C7D14E16 8.58 10.43 0.0 0.0 0
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192428 78267964 1 FNO3C20H26 ABC3D20E26 -99.48 3.49 -8.66 -0.64 1
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192429 78268148 1 SN3O4C20H32 AB3C4D20E32 -121.6 6.87 0.0 0.0 -1
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192430 78268891 1 S2O3N4H13C17 A2B3C4D13E17 45.48 11.33 0.0 0.0 0
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192431 78268892 1 ON3C23H31 AB3C23D31 -7.3 2.38 -8.48 -0.71 0