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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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292800 117359045 1 BrOC11H15 ABC11D15 -50.1 3.1 -9.23 0.02 0
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292801 117359056 1 BrOC11H15 ABC11D15 -41.61 3.07 -9.5 -0.1 0
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292802 117359060 1 BrOC11H15 ABC11D15 -47.59 4.11 -9.31 -0.08 0
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292803 117359085 1 OF3N3H8C10 AB3C3D8E10 -84.07 5.75 -10.04 -1.23 0
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292804 117359153 1 NF2O3C11H11 AB2C3D11E11 -187.89 8.31 -10.03 -0.99 0
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292805 117359156 1 NF2O3C11H11 AB2C3D11E11 -196.62 3.81 -9.02 -0.54 0
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292806 117359192 3 NOH3C4 ABC3D4 -6.33 3.03 -9.57 -1.18 0
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292807 117359213 3 NOH3C4 ABC3D4 6.97 5.55 -9.07 -1.36 0
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292808 117359216 3 NOH3C4 ABC3D4 -2.38 6.12 -9.33 -1.41 0
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292809 117359217 3 NOH3C4 ABC3D4 -3.29 9.01 -9.26 -1.19 0
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292810 117359232 1 O2N5H9C11 A2B5C9D11 -4.84 6.77 -8.77 -0.95 0
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292811 117359233 1 O2N5H9C11 A2B5C9D11 38.2 3.31 -9.41 -1.34 0
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292812 117359240 1 NOF3C12H12 ABC3D12E12 -184.48 4.2 -9.04 -0.72 0
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292813 117359255 1 FNO4C11H14 ABC4D11E14 -176.04 0.77 -9.05 -0.64 0
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292814 117359277 1 FNO4C11H14 ABC4D11E14 -192.13 5.95 -8.41 0.07 0
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292815 117359278 1 FNO4C11H14 ABC4D11E14 -202.48 5.25 -8.8 -0.14 0
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292816 117359334 1 FNO4C11H14 ABC4D11E14 -190.78 4.15 -9.56 -0.39 0
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292817 117359370 1 FN5H10C12 AB5C10D12 70.42 5.4 -8.87 -0.78 0
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292818 117359385 1 NF2O2C12H15 AB2C2D12E15 -151.48 3.13 -9.17 -0.4 0
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292819 117359386 1 NF2O2C12H15 AB2C2D12E15 -154.56 1.92 -9.27 -0.56 0
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292820 117359437 1 NF2O2C12H15 AB2C2D12E15 -161.01 2.19 -9.1 -0.74 0
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292821 117359443 1 NF2O2C12H15 AB2C2D12E15 -132.01 5.26 -8.83 -0.46 0
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292822 117359458 1 NF2O2C12H15 AB2C2D12E15 -185.51 4.79 -9.91 -0.45 0
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292823 117359460 1 NF2O2C12H15 AB2C2D12E15 -186.69 5.05 -9.65 -0.08 0
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292824 117359462 1 NF2O2C12H15 AB2C2D12E15 -185.33 2.6 -9.67 -0.15 0