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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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185020 77241040 1 SiN3O4C26H37 AB3C4D26E37 -84.9 4.89 -9.19 -1.45 0
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185021 77241596 1 Cl2O3N8C30H30 A2B3C8D30E30 0.35 5.4 -9.3 -1.57 0
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185022 77241622 1 Cl2O4N11H29C30 A2B4C11D29E30 6.46 7.02 -8.6 -1.33 0
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185023 77241623 1 Cl2O5N9C28H29 A2B5C9D28E29 -81.0 10.15 -8.91 -1.49 0
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185024 77241624 2 ClFNOC14H18 ABCDE14F18 -218.63 3.83 -8.87 -0.52 0
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185025 77241625 1 Cl2F2O3N4H28C29 A2B2C3D4E28F29 -178.35 8.12 -9.08 -1.39 0
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185026 77241713 1 Cl2O3N9H29C31 A2B3C9D29E31 40.56 11.91 -9.33 -1.78 -1
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185027 77241850 1 N2S2O8H19C20 A2B2C8D19E20 -244.89 1.51 0.0 0.0 0
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185028 77242091 1 SO2N4C17H20 AB2C4D17E20 -2.2 5.18 -9.16 -0.87 0
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185029 77242092 1 FSSiO3N5C33H36 ABCD3E5F33G36 -85.01 5.44 -8.71 -1.12 0
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185030 77242106 1 ClFO3N5C29H29 ABC3D5E29F29 -106.33 6.39 -8.89 -1.01 0
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185031 77242917 1 ClFO3N5C21H25 ABC3D5E21F25 -118.55 6.64 -8.86 -0.89 0
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185032 77243132 1 ClF3N4O5C20H20 AB3C4D5E20F20 -334.1 7.32 -9.41 -0.87 0
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185033 77243347 1 ClN5O5C23H24 AB5C5D23E24 -174.05 6.01 -9.02 -0.98 0
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185034 77243440 1 NCl2O5C16H21 AB2C5D16E21 -236.52 6.08 -9.47 -0.46 1
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185035 77243652 1 ON2C25H35 AB2C25D35 140.97 3.75 0.0 0.0 0
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185036 77243825 1 F3O3C24H25 A3B3C24D25 -260.62 2.23 -8.84 -0.59 0
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185037 77244604 1 Cl2O2N3C12H15 A2B2C3D12E15 -76.95 4.96 -9.31 -0.52 0
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185038 77244768 1 N5O6C32H51 A5B6C32D51 -257.22 5.11 -8.92 -0.62 0
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185039 77244925 1 O2N5C14H19 A2B5C14D19 11.69 6.56 -8.95 -0.71 0
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185040 77244983 1 ON8C22H22 AB8C22D22 125.91 3.52 -9.37 -1.7 0
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185041 77244984 1 FON8H21C22 ABC8D21E22 77.07 4.02 -9.46 -1.76 0
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185042 77245098 1 ClO2N3C20H24 AB2C3D20E24 -48.59 4.05 -8.62 -0.24 0
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185043 77245126 1 SO4N6C30H34 AB4C6D30E34 -27.31 13.1 -8.75 -1.88 0
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185044 77245328 2 O3N4C23H28 A3B4C23D28 -199.17 4.62 -8.58 -0.71 0