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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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171228 75346497 1 BrNSO4H26C31 ABCD4E26F31 -63.95 4.67 -8.59 -1.07 0
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171229 75346498 1 ClSN2O3H25C26 ABC2D3E25F26 -73.82 7.23 -8.41 -1.01 0
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171230 75346499 1 NS2O6H27C31 AB2C6D27E31 -156.0 6.21 -8.45 -1.04 0
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171231 75347132 1 INSO6H28C30 ABCD6E28F30 -146.64 5.21 -8.57 -1.31 0
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171232 75347171 1 ClFNSO5C31H31 ABCDE5F31G31 -192.92 3.3 -8.68 -1.48 0
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171233 75347172 1 SN2O8H28C30 AB2C8D28E30 -169.36 6.05 -8.63 -1.77 0
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171234 75347173 1 BrClNSO5C31H31 ABCDE5F31G31 -145.21 1.97 -8.72 -1.23 0
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171235 75347229 1 SN2O7C33H36 AB2C7D33E36 -214.99 3.07 -8.56 -1.62 0
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171236 75347350 1 ClSN2O5C29H29 ABC2D5E29F29 -161.08 4.8 -8.55 -1.64 0
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171237 75347775 1 NSO5H25C30 ABC5D25E30 -89.23 2.04 -8.5 -1.23 0
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171238 75348255 1 SN2O6C22H22 AB2C6D22E22 -133.85 1.97 -8.68 -1.88 0
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171239 75348436 1 BrSN2O3H23C28 ABC2D3E23F28 -26.62 8.03 -8.37 -1.19 0
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171240 75348487 1 BrClNSO6H21C30 ABCDE6F21G30 -125.73 2.36 -8.58 -1.71 0
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171241 75348505 1 BrClNSO6H23C31 ABCDE6F23G31 -135.53 1.79 -8.54 -1.75 0
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171242 75348526 1 NSCl2O4H19C24 ABC2D4E19F24 -98.26 4.12 -8.55 -1.79 0
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171243 75348716 1 NSCl2O4H19C24 ABC2D4E19F24 -98.77 3.28 -8.57 -1.8 0
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171244 75349193 1 NSO4H25C30 ABC4D25E30 -59.35 5.68 -8.44 -1.36 0
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171245 75349194 1 ClSN3O4H20C28 ABC3D4E20F28 -11.15 6.13 -8.67 -2.17 0
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171246 75349368 1 ClNSO8H16C24 ABCD8E16F24 -235.06 5.41 -9.07 -2.25 0
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171247 75349369 1 ClFNSO6H19C26 ABCDE6F19G26 -196.29 5.27 -8.92 -1.66 0
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171248 75349370 1 ClNSO5H18C25 ABCD5E18F25 -112.58 7.44 -8.9 -1.55 0
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171249 75349371 1 ClNSO4H22C29 ABCD4E22F29 -59.79 7.41 -8.88 -1.42 0
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171250 75349372 1 ClNSO5H24C30 ABCD5E24F30 -93.42 7.24 -8.83 -1.3 0
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171251 75349838 1 ClNSO7H24C27 ABCD7E24F27 -209.25 2.27 -8.64 -1.54 0
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171252 75349887 1 NSO6H23C30 ABC6D23E30 -119.71 2.47 -8.88 -1.48 0