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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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175439 75906056 1 ClSO2N4C20H26 ABC2D4E20F26 -26.38 3.56 0.0 0.0 0
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175440 75906455 1 SO2N4C19H24 AB2C4D19E24 -53.95 3.45 -8.73 -0.46 0
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175441 75906495 1 ClOSN4C24H29 ABCD4E24F29 2.77 7.96 -8.57 -0.78 0
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175442 75906496 1 ClN2O2C21H25 AB2C2D21E25 -75.79 2.82 -9.49 -0.52 0
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175443 75906497 1 ClSN2O3C20H25 ABC2D3E20F25 -116.49 4.18 -9.46 -0.81 0
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175444 75906525 1 SN2O4C26H36 AB2C4D26E36 -187.5 7.89 -9.36 0.3 0
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175445 75906567 1 F2O2N3H17C18 A2B2C3D17E18 -109.88 4.08 -8.7 -0.87 0
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175446 75906708 1 OSN5C15H21 ABC5D15E21 32.49 5.19 -9.2 -0.79 0
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175447 75906731 1 NOSC16H25 ABCD16E25 -63.62 5.55 -8.5 0.13 0
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175448 75906810 1 F2N2O5H18C23 A2B2C5D18E23 -143.97 3.3 -8.66 -1.84 1
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175449 75907088 1 ON5C20H28 AB5C20D28 46.75 4.02 0.0 0.0 0
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175450 75907219 1 O3N4C21H24 A3B4C21D24 -23.04 3.62 -8.93 -0.29 0
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175451 75907252 1 O3N4C25H38 A3B4C25D38 -151.21 7.65 -9.18 0.09 0
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175452 75907253 1 O3N4C24H36 A3B4C24D36 -146.36 7.83 -9.19 0.08 0
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175453 75907475 1 N2O5C21H30 A2B5C21D30 -228.6 4.31 -9.75 -0.25 0
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175454 75907476 1 FNO4C23H28 ABC4D23E28 -227.93 1.85 -9.7 -0.51 0
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175455 75907574 1 Cl2N3O4H17C18 A2B3C4D17E18 -68.5 9.99 -9.41 -1.4 0
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175456 75908088 1 ClNO3H16C18 ABC3D16E18 -82.2 3.93 -9.45 -0.5 0
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175457 75908167 1 N3O4C23H37 A3B4C23D37 -184.83 4.74 -8.88 0.15 1
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175458 75908168 1 SO3N4C23H37 AB3C4D23E37 -125.89 4.57 0.0 0.0 0
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175459 75908169 1 SO3N4C23H36 AB3C4D23E36 -128.24 6.86 -8.67 -0.04 0
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175460 75908191 1 ClNO4H18C19 ABC4D18E19 -128.25 4.48 -9.64 -0.61 0
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175461 75908251 1 SF3O3N4C18H23 AB3C3D4E18F23 -272.4 3.45 -9.2 -0.58 0
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175462 75908736 1 BrClN3O3C19H19 ABC3D3E19F19 -54.71 4.23 -9.16 -0.62 0
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175463 75908737 1 BrF2N3O3C20H20 AB2C3D3E20F20 -168.55 4.64 -9.16 -0.82 0