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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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179359 76470110 1 NSO3C16H17 ABC3D16E17 -66.59 4.51 -8.96 -0.63 0
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179360 76470819 1 F6N6C25H26 A6B6C25D26 -209.66 7.11 -8.16 -1.5 0
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179361 76470921 1 OCl2N2H16C18 AB2C2D16E18 65.55 2.04 -9.03 -0.64 0
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179362 76470925 1 PSN6O8C27H37 ABC6D8E27F37 -347.37 2.64 -8.86 -0.45 0
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179363 76471000 1 SN6F7O10C39H45 AB6C7D10E39F45 -707.6 7.23 -9.74 -1.67 0
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179364 76471159 1 F2O3N4H20C21 A2B3C4D20E21 -131.72 6.3 -9.0 -0.44 0
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179365 76471201 1 Cl2F3O4H19C21 A2B3C4D19E21 -308.52 7.05 -9.87 -1.22 0
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179366 76472012 1 ON3C15H25 AB3C15D25 -27.24 6.86 -8.88 -0.66 0
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179367 76472013 1 SN2O3C21H28 AB2C3D21E28 -100.09 4.26 -9.13 -0.62 0
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179368 76472014 4 OC8H11 AB8C11 -174.62 5.52 -8.81 0.12 0
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179369 76472517 1 S2O6C9H20 A2B6C9D20 -287.89 4.52 -9.04 0.09 0
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179370 76472791 1 F2O5C24H38 A2B5C24D38 -411.66 4.99 -10.46 0.58 0
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179371 76472877 1 S2N5O5C23H27 A2B5C5D23E27 -78.13 9.25 -9.62 -1.37 0
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179372 76472878 1 S2O5N7C36H47 A2B5C7D36E47 -135.4 11.27 -9.04 -0.73 0
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179373 76473930 1 N2O5C24H30 A2B5C24D30 -168.06 5.02 -8.93 -0.76 0
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179374 76473931 1 SN4O6C42H66 AB4C6D42E66 -310.48 6.14 -9.21 -0.96 0
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179375 76473932 1 F3N4O4C28H31 A3B4C4D28E31 -225.98 5.68 -9.03 -1.41 0
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179376 76473933 1 O4C23H34 A4B23C34 -210.59 5.58 -9.91 -0.32 0
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179377 76473936 1 F2N3O4H23C26 A2B3C4D23E26 -198.86 7.88 -9.08 -0.66 0
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179378 76473937 1 N3O5C16H29 A3B5C16D29 -202.26 1.05 -10.07 -0.77 1
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179379 76473938 1 N4O5C37H41 A4B5C37D41 -84.63 3.09 0.0 0.0 0
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179380 76474145 1 IO2C21H29 AB2C21D29 -101.95 4.86 -9.86 -1.38 0
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179381 76474170 2 NO3C17H17 AB3C17D17 -195.88 1.61 -8.85 -0.69 0
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179382 76474474 1 N3O6C23H31 A3B6C23D31 -195.75 7.35 -8.31 -0.66 0
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179383 76475142 1 PF3N4O4C13H20 AB3C4D4E13F20 -365.16 2.39 -9.17 -0.03 0