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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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169998 75179160 2 O2H11C12 A2B11C12 -100.47 4.0 -8.82 0.07 0
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169999 75179161 1 N2O4H18C19 A2B4C18D19 -111.46 5.38 -9.16 -0.92 0
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170000 75179162 1 N3O4C19H19 A3B4C19D19 -77.73 5.08 -8.98 -0.97 0
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170001 75179163 1 N4O6H18C19 A4B6C18D19 -82.36 4.27 -9.64 -1.4 0
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170002 75179164 1 N3O6H17C19 A3B6C17D19 -119.76 5.18 -9.59 -1.35 0
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170003 75179165 1 N3O6H17C19 A3B6C17D19 -117.9 9.42 -9.84 -1.62 0
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170004 75179166 1 N2O4C21H30 A2B4C21D30 -179.07 6.73 -9.64 -0.77 0
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170005 75179395 1 F3N3O5C22H22 A3B3C5D22E22 -324.09 3.51 -9.14 -1.05 0
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170006 75179573 1 NaF3N3O13C30H39 AB3C3D13E30F39 -706.68 30.18 -8.44 -0.7 0
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170007 75180363 1 N3O8C34H45 A3B8C34D45 -203.72 4.59 -8.74 -0.93 0
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170008 75180459 3 O5C12H12 A5B12C12 -505.5 5.53 -8.62 -0.7 0
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170009 75181191 1 ClSO3N7C23H24 ABC3D7E23F24 -26.7 7.92 -8.95 -1.12 0
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170010 75181516 1 O7C31H34 A7B31C34 -207.57 3.62 -8.72 -1.0 0
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170011 75181517 1 O5C23H28 A5B23C28 -150.77 2.12 -8.74 -0.93 0
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170012 75181518 1 O5C23H28 A5B23C28 -166.66 3.06 -8.73 -0.87 0
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170013 75181519 1 O5C23H28 A5B23C28 -173.21 3.58 -8.77 -0.99 0
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170014 75181683 1 Br2H12C15 A2B12C15 58.12 2.33 -9.23 -0.5 0
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170015 75181818 1 SF3N3O5C40H52 AB3C3D5E40F52 -371.77 5.75 -8.65 -0.98 0
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170016 75181819 1 N2O3C20H32 A2B3C20D32 -153.87 2.24 -9.38 0.24 0
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170017 75182491 1 ClSN2O2H15C18 ABC2D2E15F18 -11.12 1.64 -9.02 -0.9 0
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170018 75182595 2 NO5C11H16 AB5C11D16 -406.79 5.82 -9.13 -0.5 1
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170019 75183080 1 ClO2N4C16H16 AB2C4D16E16 4.67 2.08 0.0 0.0 0
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170020 75183325 1 SO5C12H14 AB5C12D14 -198.13 7.04 -9.42 -1.13 0
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170021 75183500 1 Cl2N5O7C34H41 A2B5C7D34E41 -268.09 2.13 -8.86 -0.68 0
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170022 75183839 1 PN2O10C24H41 AB2C10D24E41 -551.21 6.44 -9.95 0.32 0