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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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281275 103913636 1 ON3C16H23 AB3C16D23 19.16 3.01 -9.15 -0.3 0
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281276 103913637 1 ON2C16H22 AB2C16D22 22.22 2.72 -9.37 -0.06 0
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281277 103913638 1 ON2C17H24 AB2C17D24 -12.14 2.16 -9.12 0.23 0
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281278 103913639 1 ON2C18H26 AB2C18D26 -16.45 2.03 -9.12 0.23 0
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281279 103913640 1 ON2C18H26 AB2C18D26 -20.99 1.82 -9.0 0.3 0
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281280 103913642 1 ON2C13H16 AB2C13D16 10.35 3.18 -8.54 0.57 0
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281281 103913643 1 OC13H18 AB13C18 -49.02 1.0 -8.51 0.59 0
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281282 103913644 1 BrSO2C10H13 ABC2D10E13 -49.25 5.47 -8.37 -0.08 0
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281283 103913645 1 FN2H15C16 AB2C15D16 17.08 3.65 -8.37 -1.04 0
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281284 103913647 1 BrFN2H10C14 ABC2D10E14 36.33 3.67 -8.9 -1.16 0
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281285 103913649 1 FN2H15C16 AB2C15D16 20.6 4.36 -8.83 -1.01 0
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281286 103913650 1 FN2H15C16 AB2C15D16 18.75 4.56 -8.35 -0.98 0
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281287 103913651 2 FNH5C7 ABC5D7 -11.92 3.05 -8.72 -1.13 0
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281288 103913652 1 ClFN2H10C14 ABC2D10E14 26.03 3.6 -8.72 -1.11 0
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281289 103913653 1 FCl2N2H9C14 AB2C2D9E14 18.32 3.7 -8.79 -1.26 0
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281290 103913654 1 FCl2N2H9C14 AB2C2D9E14 17.05 4.17 -8.91 -1.27 0
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281291 103913655 1 ClFN2H10C14 ABC2D10E14 24.03 3.67 -8.88 -1.16 0
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281292 103913656 1 FN2H13C18 AB2C13D18 52.44 3.44 -8.34 -1.12 0
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281293 103913658 1 ClFN2H10C14 ABC2D10E14 25.15 3.13 -8.68 -1.17 0
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281294 103913659 1 N2F4H10C15 A2B4C10D15 -127.53 3.6 -9.05 -1.25 0
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281295 103913661 2 FNH5C7 ABC5D7 -9.88 3.5 -8.77 -1.09 0
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281296 103913662 1 ClFN2H12C15 ABC2D12E15 17.07 3.27 -8.79 -1.13 0
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281297 103913663 1 FCl2N2H9C14 AB2C2D9E14 14.42 6.08 -8.9 -1.38 0
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281298 103913665 1 FN3H10C15 AB3C10D15 65.19 4.86 -9.0 -1.31 0
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281299 103913667 1 ClF2N2H9C14 AB2C2D9E14 -20.85 3.6 -8.9 -1.23 0