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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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193694 78425270 1 Br2O2C11H11 A2B2C11D11 -20.1 2.43 0.0 0.0 0
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193695 78426065 1 N3O3C16H27 A3B3C16D27 -144.79 2.71 -8.99 0.56 0
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193696 78426066 1 N3O4C15H25 A3B4C15D25 -187.72 5.96 -9.26 0.59 0
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193697 78426067 1 FCl2S2O3N7H10C18 AB2C2D3E7F10G18 37.54 10.4 -8.88 -2.03 0
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193698 78426068 1 Cl2S2O3N7H11C18 A2B2C3D7E11F18 80.94 12.37 -8.77 -1.96 0
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193699 78426182 1 FN3O6C25H28 AB3C6D25E28 -247.04 3.91 -8.17 -1.48 0
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193700 78426235 1 Cl2N2O9C43H50 A2B2C9D43E50 35.94 58.33 -5.99 -5.19 0
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193701 78426248 1 OF3N4C17H27 AB3C4D17E27 -186.6 4.93 -8.66 -0.53 0
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193702 78426815 1 ClF2O3N4H23C29 AB2C3D4E23F29 -91.73 3.61 -8.93 -1.09 0
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193703 78426816 1 F2O3N4H26C30 A2B3C4D26E30 -88.92 3.81 -8.83 -1.0 0
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193704 78427174 1 O3N5H19C26 A3B5C19D26 64.68 11.55 -8.95 -1.16 0
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193705 78427175 1 O3N6H24C28 A3B6C24D28 63.73 14.02 -8.47 -1.03 0
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193706 78427176 1 O3N5H17C21 A3B5C17D21 40.54 12.17 -8.83 -1.11 0
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193707 78427177 1 O4N5H23C28 A4B5C23D28 23.59 13.43 -8.68 -1.03 0
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193708 78427178 1 O3N6H28C34 A3B6C28D34 57.33 12.67 -8.4 -0.98 0
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193709 78427398 1 SO2N3H13C18 AB2C3D13E18 50.93 4.78 -8.86 -1.49 0
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193710 78427399 1 SO2N4H12C17 AB2C4D12E17 63.43 2.75 -9.02 -1.63 0
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193711 78427400 1 SO2N4H12C19 AB2C4D12E19 84.93 5.28 -9.07 -1.63 0
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193712 78428070 1 SO2F3N3C15H16 AB2C3D3E15F16 -191.98 8.03 -9.2 -1.12 0
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193713 78428071 1 S2F3N3O4H18C20 A2B3C3D4E18F20 -231.79 10.24 -9.27 -1.74 1
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193714 78428547 1 ON2C18H21 AB2C18D21 15.75 3.22 0.0 0.0 -1
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193715 78429094 1 FNO5H15C16 ABC5D15E16 -169.75 3.76 0.0 0.0 0
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193716 78429095 1 SO2N3C13H15 AB2C3D13E15 -44.34 7.22 -9.69 -0.76 0
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193717 78429096 1 SN2O3C18H18 AB2C3D18E18 -40.19 5.15 -9.79 -0.93 0
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193718 78429161 1 N2O3C14H18 A2B3C14D18 -87.72 14.73 -9.37 -1.2 1