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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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251475 103104254 1 OC6N6H12 AB6C6D12 8.64 5.53 -8.88 0.05 0
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251476 103104257 1 ON3C10H21 AB3C10D21 -62.51 4.13 -8.93 1.12 0
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251477 103104268 1 ON5C8H13 AB5C8D13 -1.6 5.66 -9.18 -0.72 0
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251478 103104271 1 BrON5C8H12 ABC5D8E12 -21.84 4.89 -9.13 -0.47 0
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251479 103104272 1 ON4C9H14 AB4C9D14 -22.9 4.35 -8.63 0.13 0
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251480 103104276 1 ON5C15H21 AB5C15D21 -2.79 3.4 -8.54 -0.68 0
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251481 103104277 1 ClON5C9H14 ABC5D9E14 -15.83 5.45 -8.79 -0.28 0
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251482 103104279 1 ClON6C10H17 ABC6D10E17 -20.7 4.17 -9.48 -0.46 0
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251483 103104281 1 ON5C11H17 AB5C11D17 -1.7 2.59 -9.1 -0.18 0
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251484 103104305 1 ON5C12H21 AB5C12D21 -39.11 2.95 -9.06 -0.05 0
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251485 103104312 1 OF3N4C12H17 AB3C4D12E17 -191.0 5.16 -8.78 -0.45 0
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251486 103104313 1 ON4C10H16 AB4C10D16 -21.95 3.89 -8.47 0.2 0
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251487 103104329 1 ON5C15H27 AB5C15D27 -49.76 5.95 -8.92 -0.04 0
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251488 103104330 1 ON8C12H18 AB8C12D18 31.28 6.44 -9.63 -0.84 0
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251489 103104333 1 ON5C10H17 AB5C10D17 -24.45 3.07 -8.91 0.09 0
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251490 103104336 1 O3N4C13H20 A3B4C13D20 -46.7 3.23 -8.76 -1.16 0
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251491 103104351 1 O3N6C8H12 A3B6C8D12 -20.53 0.98 -9.64 -1.28 0
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251492 103104358 1 ON5C12H21 AB5C12D21 -26.86 3.33 -8.6 0.04 0
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251493 103104363 1 ON7C12H23 AB7C12D23 -21.17 4.77 -9.14 0.19 0
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251494 103104394 1 ON5C10H17 AB5C10D17 -20.77 2.58 -8.99 -0.06 0
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251495 103104401 1 ON5C14H25 AB5C14D25 -49.59 4.61 -8.83 0.19 0
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251496 103104421 1 BrON5C9H14 ABC5D9E14 -5.7 5.74 -8.92 -0.38 0
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251497 103104431 1 O2N7C11H19 A2B7C11D19 -46.63 3.63 -9.3 -0.08 0
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251498 103104433 1 ON5C10H17 AB5C10D17 -15.74 3.69 -8.49 -0.1 0
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251499 103104453 1 ON5C9H15 AB5C9D15 -15.95 2.95 -9.02 -0.42 0