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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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189566 77874237 1 SN3O7C23H25 AB3C7D23E25 -248.65 6.43 -8.96 -0.69 0
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189567 77874238 2 NO2C10H10 AB2C10D10 -81.72 5.74 -9.82 -1.51 0
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189568 77874274 1 Si2O3C29H54 A2B3C29D54 -279.66 3.57 -8.81 0.5 0
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189569 77875013 1 SN4O4C12H14 AB4C4D12E14 -72.56 3.69 -9.39 -0.63 0
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189570 77875443 1 SO4N5C15H15 AB4C5D15E15 -65.35 11.78 -9.39 -1.72 0
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189571 77875447 1 SN4O7C26H30 AB4C7D26E30 -235.21 7.76 -8.78 -1.47 0
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189572 77875475 1 N5O7C23H29 A5B7C23D29 -235.51 3.31 -8.77 -1.35 0
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189573 77875659 2 O3C14H16 A3B14C16 -212.85 4.12 -9.18 0.08 0
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189574 77875660 1 FSSiN4O7H41C44 ABCD4E7F41G44 -98.77 6.59 -8.14 -1.44 0
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189575 77875661 1 FO2N3C14H14 AB2C3D14E14 -57.87 7.65 -9.11 -1.15 0
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189576 77875681 1 N3O3C19H21 A3B3C19D21 -74.92 5.64 -8.98 -0.19 0
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189577 77875749 1 S3N5O9C27H31 A3B5C9D27E31 -271.93 3.67 -9.07 -1.06 0
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189578 77875904 1 FSiN3O4H36C38 ABC3D4E36F38 -86.13 7.07 -9.06 -1.28 0
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189579 77875905 2 ON2C8H12 AB2C8D12 -73.42 8.45 -8.87 -0.08 0
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189580 77875906 3 NC6H9 AB6C9 24.93 2.58 -7.81 0.45 0
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189581 77875907 1 ON2C14H16 AB2C14D16 -7.04 6.65 -9.69 -0.63 0
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189582 77875926 1 Cl2O4N5H11C13 A2B4C5D11E13 -94.4 4.49 -9.61 -1.83 0
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189583 77876073 1 NO5C14H25 AB5C14D25 -248.37 4.78 -10.39 0.26 0
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189584 77876245 1 NCl2O9C21H23 AB2C9D21E23 -363.02 5.51 -8.96 -1.3 0
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189585 77876648 1 SO5C24H46 AB5C24D46 -324.99 1.88 -8.88 0.37 0
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189586 77876664 1 N2O7C30H36 A2B7C30D36 -278.6 6.47 -9.56 -0.41 0
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189587 77876875 1 PN8O10C23H33 AB8C10D23E33 -434.89 14.18 -8.79 -0.88 0
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189588 77876882 1 NO4C28H49 AB4C28D49 -257.06 3.21 -9.03 0.64 0
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189589 77876883 1 CoO6C14H20 AB6C14D20 -299.47 16.35 0.0 0.0 0
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189590 77876979 1 O5C23H36 A5B23C36 -267.67 3.62 -8.71 0.7 0
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189591 77876980 1 N2S2O3C10H12 A2B2C3D10E12 -71.14 4.44 -9.14 -1.29 0
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189592 77877235 1 N4O11C27H40 A4B11C27D40 -498.26 8.28 -9.52 0.17 0
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189593 77877316 1 N2O4C25H34 A2B4C25D34 -144.61 4.67 -7.57 -1.46 0
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189594 77877317 1 N2O4C25H34 A2B4C25D34 -142.93 4.02 -7.66 -1.3 0
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189595 77877318 1 SO5N6C20H32 AB5C6D20E32 -166.66 3.09 -8.96 -0.87 0
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189596 77877492 1 BrS2O4C25H35 AB2C4D25E35 -175.22 4.36 -8.46 -0.08 0
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189597 77877844 1 F3O6C24H29 A3B6C24D29 -355.3 9.86 -9.17 -0.86 0
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189598 77878390 1 BrFO8C23H28 ABC8D23E28 -253.42 7.07 -9.5 -1.19 0
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189599 77879230 1 ClNO2C17H24 ABC2D17E24 -94.01 1.63 -9.12 -0.38 0
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189600 77879231 1 FN2O9C33H41 AB2C9D33E41 -373.93 3.9 -8.1 -0.62 0
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189601 77879334 1 O2C23H34 A2B23C34 -120.42 6.49 -9.63 0.5 0
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189602 77879509 4 OC5H8 AB5C8 -198.06 1.64 -9.81 0.11 0
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189603 77879828 1 N3O5H11C15 A3B5C11D15 -92.89 9.08 -10.54 -2.96 0
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189604 77879829 1 SN3O7H15C16 AB3C7D15E16 -160.78 7.06 -9.59 -1.51 0
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189605 77879830 1 ClNO2C18H24 ABC2D18E24 -78.15 8.98 -8.77 -0.27 0
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189606 77879831 1 NO2C18H23 AB2C18D23 -56.25 2.19 -8.97 0.2 0
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189607 77880022 1 ClN6C17H21 AB6C17D21 131.55 8.08 -9.02 -0.23 1
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189608 77880023 1 N4O6C26H27 A4B6C26D27 -102.45 8.79 0.0 0.0 0
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189609 77880077 1 BrO6C28H49 AB6C28D49 -351.83 4.55 -10.33 -0.47 0
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189610 77880200 1 ClO2C26H41 AB2C26D41 -167.56 3.42 -9.09 0.2 0
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189611 77880438 2 O2C14H23 A2B14C23 -194.77 5.25 -9.56 -0.38 0
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189612 77880677 2 N2O5C10H18 A2B5C10D18 -477.14 7.29 -9.84 0.2 0
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189613 77881502 1 N4O5S5C16H16 A4B5C5D16E16 -78.9 7.16 -9.2 -1.25 0
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189614 77881773 1 SSnN2O2Cl3C9H14 ABC2D2E3F9G14 -52.53 2.39 0.0 0.0 0
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189615 77881842 1 N3O4C10H15 A3B4C10D15 -151.72 4.25 -10.31 -1.38 0