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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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142509 53047296 1 NS2O5H19C23 AB2C5D19E23 -62.99 5.54 -8.62 -1.05 0
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142510 53047297 1 NS2O5H21C22 AB2C5D21E22 -131.03 10.12 -8.53 -0.94 0
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142511 53047678 1 ON5C25H29 AB5C25D29 16.0 2.96 -8.39 -0.14 0
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142512 53047679 1 ClFON5C23H23 ABCD5E23F23 -20.14 3.63 -8.4 -0.88 0
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142513 53048027 1 ON6C24H28 AB6C24D28 14.79 2.98 -8.32 -0.2 0
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142514 53048139 1 ClSO2N5C22H24 ABC2D5E22F24 -15.66 3.99 -8.55 -1.14 0
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142515 53048474 1 FO3N4H15C18 AB3C4D15E18 -64.97 7.26 -8.94 -1.62 1
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142516 53048475 1 O3N4H17C18 A3B4C17D18 -31.29 1.95 0.0 0.0 0
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142517 53048476 1 O3N4H16C18 A3B4C16D18 -17.33 6.54 -8.83 -1.56 0
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142518 53049277 1 SO2N4C28H28 AB2C4D28E28 23.6 7.12 -8.82 -0.46 0
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142519 53049278 1 SO2N4C28H28 AB2C4D28E28 22.85 4.49 -8.95 -0.57 0
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142520 53049413 4 NOC7H7 ABC7D7 -46.9 4.7 -8.82 -0.49 0
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142521 53049698 1 ClSO2N3C20H22 ABC2D3E20F22 -24.32 5.37 -8.62 -0.58 0
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142522 53049847 1 ClN4O4H25C28 AB4C4D25E28 -46.94 4.36 -8.07 -0.65 0
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142523 53049848 1 ClO3N4H23C27 AB3C4D23E27 -15.57 5.3 -8.7 -0.78 0
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142524 53049849 1 ClO3N4H23C27 AB3C4D23E27 -12.03 5.16 -8.37 -0.7 0
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142525 53050089 1 SO3N4C25H26 AB3C4D25E26 -55.43 7.04 -8.7 -0.39 0
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142526 53050620 1 FSO3N5C24H24 ABC3D5E24F24 -71.88 4.49 -8.82 -0.92 0
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142527 53051270 1 FON3C23H26 ABC3D23E26 -24.3 3.87 -8.41 -0.02 0
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142528 53051383 1 N3O3C24H25 A3B3C24D25 -12.1 5.5 -8.85 -0.63 0
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142529 53051384 1 N3O3C23H25 A3B3C23D25 -33.61 5.31 -8.98 -0.64 0
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142530 53051513 1 ClN3O3C22H22 AB3C3D22E22 -30.88 2.32 -9.09 -0.67 0
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142531 53051538 1 ON4C16H16 AB4C16D16 50.68 4.33 -8.8 -0.99 0
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142532 53051539 1 ON4C16H16 AB4C16D16 49.25 4.25 -8.69 -0.98 0
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142533 53051540 1 BrFON4H10C14 ABCD4E10F14 20.49 5.65 -9.19 -1.15 0