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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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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