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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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175739 75942648 1 O4N5C22H31 A4B5C22D31 -164.32 5.65 -9.11 -0.8 0
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175740 75942649 1 SN4O4C23H30 AB4C4D23E30 -147.25 4.6 -9.41 -1.18 0
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175741 75942650 1 SN4O4C20H30 AB4C4D20E30 -176.08 5.06 -8.43 -0.52 0
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175742 75942654 1 Cl2N3O5C21H29 A2B3C5D21E29 -241.98 5.5 -9.01 -0.33 0
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175743 75942655 1 N3O5C25H37 A3B5C25D37 -252.75 2.5 -9.45 -0.5 0
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175744 75942656 1 O4N5C24H33 A4B5C24D33 -148.69 4.42 -9.36 -0.05 0
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175745 75942916 1 N2O3C18H26 A2B3C18D26 -139.81 5.34 -8.65 0.22 0
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175746 75943000 1 N2F3O4C21H29 A2B3C4D21E29 -335.19 4.62 -8.92 -0.17 0
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175747 75943014 1 N3O3C20H29 A3B3C20D29 -125.11 1.03 -8.54 -0.13 0
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175748 75943065 1 BrN4O4H15C18 AB4C4D15E18 -88.05 9.0 -8.93 -1.92 0
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175749 75943066 1 BrN3O3C17H20 AB3C3D17E20 -96.5 7.12 -8.98 -0.54 0
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175750 75943189 1 N3O4C22H35 A3B4C22D35 -184.04 4.58 -8.11 0.26 0
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175751 75943190 1 SO2N4C23H30 AB2C4D23E30 -53.43 3.49 -8.15 -0.79 0
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175752 75943191 1 N3O3C26H31 A3B3C26D31 -87.76 2.94 -8.14 -0.76 0
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175753 75943221 1 BrClFNOH14C17 ABCDEF14G17 -37.32 2.59 -9.68 -0.49 0
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175754 75943419 2 OF2N2C10H10 AB2C2D10E10 -246.58 7.58 -9.27 -0.83 0
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175755 75943420 1 F3N3O3C20H28 A3B3C3D20E28 -299.23 3.44 -9.52 0.18 0
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175756 75943569 1 N2S2O7C19H26 A2B2C7D19E26 -285.31 11.51 -9.94 -1.04 0
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175757 75943570 1 SN2O7C19H28 AB2C7D19E28 -277.23 5.7 -8.88 -0.54 0
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175758 75943571 1 SN2O6C24H28 AB2C6D24E28 -208.4 5.53 -9.56 -1.29 1
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175759 75943728 1 F2N3O3C22H26 A2B3C3D22E26 -169.88 4.72 0.0 0.0 0
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175760 75943882 1 O3N4C27H28 A3B4C27D28 -8.09 6.89 -8.89 -1.35 1
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175761 75944134 1 ClO3N4C24H24 AB3C4D24E24 -19.83 5.4 0.0 0.0 0
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175762 75944135 1 ClO3N4H23C24 AB3C4D23E24 -45.13 3.58 -9.12 -0.85 0
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175763 75944725 1 NSF3O3C18H20 ABC3D3E18F20 -250.51 6.65 -9.04 -0.62 0