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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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242527 97301856 1 ClSN3O3C13H20 ABC3D3E13F20 -110.96 4.66 -9.12 -1.11 0
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242528 97301865 1 ClN2O2C26H29 AB2C2D26E29 -27.03 3.85 -8.47 -0.12 0
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242529 97301870 1 ClNOC26H26 ABCD26E26 30.51 2.73 -8.61 -0.16 0
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242530 97301875 1 NO2C28H39 AB2C28D39 -66.48 2.48 -8.41 0.4 0
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242531 97301882 1 N2O4C27H30 A2B4C27D30 -11.46 6.23 -8.89 -0.3 0
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242532 97301884 1 ClO2N3C25H28 AB2C3D25E28 -2.23 2.31 -8.05 -0.3 0
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242533 97301885 1 N2O4C27H30 A2B4C27D30 -10.73 7.57 -8.79 -0.66 0
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242534 97301886 2 NO2C15H17 AB2C15D17 -20.99 4.96 -8.82 -0.72 0
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242535 97301901 1 SN4O5C19H32 AB4C5D19E32 -199.54 9.67 -9.66 -0.38 0
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242536 97301902 1 SN4O5C19H32 AB4C5D19E32 -196.06 8.16 -9.43 -0.39 0
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242537 97301903 1 SN4O5C21H28 AB4C5D21E28 -155.71 8.6 -8.63 -0.68 0
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242538 97301905 1 ClN2S2H5C6 AB2C2D5E6 54.6 3.09 -9.08 -1.3 0
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242539 97301915 1 ON2C13H16 AB2C13D16 -8.43 3.2 -8.17 -0.31 0
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242540 97301927 1 N2O5C20H26 A2B5C20D26 -158.51 6.61 -8.29 -0.23 0
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242541 97301929 1 SCl2O5H8C9 AB2C5D8E9 -199.01 5.22 -9.65 -1.34 0
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242542 97301955 1 NSO2C9H13 ABC2D9E13 -40.45 3.86 -8.49 -0.19 0
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242543 97301957 1 NSO2C9H13 ABC2D9E13 -39.24 5.29 -8.06 -0.35 0
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242544 97301961 1 NO2C14H15 AB2C14D15 -23.21 2.92 -8.34 -0.06 0
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242545 97301968 1 NO3C17H27 AB3C17D27 -138.62 6.11 -9.21 -0.38 0
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242546 97301977 1 NO3C20H25 AB3C20D25 -86.5 5.09 -9.26 -0.54 0
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242547 97301980 1 NO3C20H25 AB3C20D25 -91.94 3.65 -9.29 -0.54 1
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242548 97301993 1 NO2C26H34 AB2C26D34 -43.3 1.36 0.0 0.0 0
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242549 97302002 1 NO2C12H17 AB2C12D17 -77.04 2.58 -8.51 0.46 0
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242550 97302009 1 NS2O4C11H17 AB2C4D11E17 -189.02 5.65 -9.24 -0.31 0
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242551 97302020 1 NSO6C17H19 ABC6D17E19 -225.54 6.53 -8.98 -0.45 0