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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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144244 53336979 1 SO3N5C26H33 AB3C5D26E33 -54.62 4.86 -8.69 -0.29 0
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144245 53336980 1 SO3N5C22H31 AB3C5D22E31 -56.99 5.83 -8.72 -0.23 0
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144246 53337583 1 SO3N4H20C21 AB3C4D20E21 23.07 7.19 -8.38 -0.8 0
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144247 53337673 1 NSO4H9C10 ABC4D9E10 -109.66 4.7 -10.63 -1.4 0
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144248 53337738 1 BrClO2N4C19H22 ABC2D4E19F22 -46.97 8.5 -8.69 -0.95 -1
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144249 53337747 1 O2N3S3H10C13 A2B3C3D10E13 49.71 13.79 0.0 0.0 0
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144250 53338032 1 SF2N3O3C17H17 AB2C3D3E17F17 -135.25 7.17 -8.89 -1.31 0
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144251 53338297 1 ClSN3C19H20 ABC3D19E20 68.0 2.1 -7.72 -0.36 1
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144252 53338510 1 NOC23H30 ABC23D30 63.73 2.87 0.0 0.0 0
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144253 53338591 1 SN3O5C17H23 AB3C5D17E23 -174.48 4.21 -8.77 -1.53 0
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144254 53338734 1 NO2C6H13 AB2C6D13 -99.83 3.45 -9.22 1.86 0
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144255 53338910 1 ClON3H18C24 ABC3D18E24 85.83 3.82 -9.06 -1.46 0
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144256 53338911 1 N3O3F9H28C29 A3B3C9D28E29 -533.12 10.14 -9.73 -0.85 0
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144257 53338912 1 Cl2S2N4O4C21H24 A2B2C4D4E21F24 -121.06 7.16 -9.24 -1.82 0
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144258 53338913 1 NO4C16H23 AB4C16D23 -174.99 3.26 -9.41 0.16 0
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144259 53338961 2 NOC9H10 ABC9D10 -7.22 5.48 -9.56 -0.63 0
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144260 53339496 1 SN4O6C23H32 AB4C6D23E32 -223.68 5.09 -9.34 -0.92 0
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144261 53339816 2 SO2F3N7C18H23 AB2C3D7E18F23 -389.75 6.95 -9.08 -1.92 0
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144262 53339962 1 ClOF3N6C30H32 ABC3D6E30F32 -121.4 2.85 -8.13 -0.8 0
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144263 53339963 1 ClOF3N4H18C23 ABC3D4E18F23 -119.11 3.22 -8.22 -0.99 0
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144264 53340136 1 SO2N4C28H36 AB2C4D28E36 -45.45 1.47 -8.4 -0.6 0
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144265 53340168 1 SF3N3O8C33H36 AB3C3D8E33F36 -424.11 4.62 -9.39 -0.93 0
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144266 53340173 2 NO4C17H26 AB4C17D26 -206.59 6.13 -9.22 -0.78 0
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144267 53340195 1 O3N5C25H37 A3B5C25D37 -80.67 6.04 -8.89 -0.33 0
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144268 53340596 1 FON5C20H20 ABC5D20E20 -8.75 4.11 -9.09 -0.59 0