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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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7549 73360 1 NO5C18H21 AB5C18D21 -161.92 3.92 -8.86 -0.35 0
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7550 73361 1 S3O12C29H52 A3B12C29D52 -589.14 7.48 -10.37 -1.43 0
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7551 73366 1 F2N3O3C20H23 A2B3C3D20E23 -163.29 15.19 -8.76 -0.95 0
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7552 73367 1 N10O13C61H104 A10B13C61D104 -682.0 15.54 -9.0 0.01 0
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7553 73368 1 O16C59H92 A16B59C92 -636.82 3.61 -9.07 0.48 0
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7554 73369 1 O9C41H64 A9B41C64 -406.6 10.45 -8.86 -0.55 0
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7555 73370 1 NO13C40H51 AB13C40D51 -538.19 6.25 -8.63 -1.29 0
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7556 73371 2 NO4C15H21 AB4C15D21 -280.13 5.4 -9.26 -1.39 0
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7557 73372 1 ClO3N5C48H48 AB3C5D48E48 47.79 17.35 -7.47 -1.62 0
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7558 73373 1 O3N5C48H48 A3B5C48D48 193.49 20.03 0.0 0.0 1
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7559 73375 1 O3N7C30H33 A3B7C30D33 -38.73 4.13 -8.75 0.09 0
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7560 73376 1 NO2S2C7H13 AB2C2D7E13 -87.02 7.7 -9.13 -0.8 0
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7561 73378 1 N2S2C7H14 A2B2C7D14 7.41 3.76 -8.63 -0.5 0
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7563 73397 1 NO4C21H27 AB4C21D27 -110.6 3.25 -7.86 0.18 0
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7564 73400 2 NO3C19H22 AB3C19D22 -137.0 3.8 -8.03 0.22 0
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7565 73416 1 NO6C18H21 AB6C18D21 -184.3 5.09 -8.08 -0.89 0
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7566 73421 1 O7H14C15 A7B14C15 -261.79 2.97 -9.32 -2.26 0
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7567 73422 1 ClNO5C18H22 ABC5D18E22 -137.84 2.75 -8.89 -0.4 0
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7568 73426 1 NO3C18H19 AB3C18D19 -61.44 8.67 -8.71 -0.42 0
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7569 73430 7 O2C5H8 A2B5C8 -588.57 3.0 -9.81 -0.39 0
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7570 73431 2 O7H15C16 A7B15C16 -557.25 0.24 -8.55 -1.02 0
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7571 73432 1 O11C26H32 A11B26C32 -443.45 1.81 -9.4 -0.67 0
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7572 73433 2 NOC5H11 ABC5D11 -105.66 2.81 -8.78 1.98 0
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7573 73435 1 S3N6O10H28C35 A3B6C10D28E35 -162.16 11.52 -9.24 -1.48 0
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7574 73436 1 SNa2N6O7H24C31 AB2C6D7E24F31 -86.5 46.81 -6.7 -2.96 0
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7575 73438 1 N3O5C8H15 A3B5C8D15 -228.79 6.3 -10.21 0.16 0
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7576 73439 1 NO4C9H11 AB4C9D11 -155.84 4.55 -10.12 -0.27 0
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7577 73440 1 O3C15H16 A3B15C16 -91.86 8.3 -9.74 -0.41 0
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7578 73441 1 O10C25H26 A10B25C26 -385.32 3.79 -9.92 -2.44 0
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7579 73443 1 N2O3C6H12 A2B3C6D12 -114.19 5.86 -9.71 0.38 0
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7580 73444 1 N5O7C30H51 A5B7C30D51 -359.97 9.26 -9.23 -0.24 0
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7582 73446 1 Cl2N3O11H33C34 A2B3C11D33E34 -298.9 10.01 -8.94 -1.82 0
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7583 73447 1 O5H22C23 A5B22C23 -166.72 4.19 -9.11 -0.43 0
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7584 73450 1 ClON3C15H24 ABC3D15E24 -45.49 5.32 -8.68 -0.99 0
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7585 73451 2 ON2C7H10 AB2C7D10 -27.47 3.05 -9.74 0.33 0
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7586 73452 1 N2O7C12H20 A2B7C12D20 -294.57 1.33 -10.42 -1.25 0
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7587 73455 2 MnSF3O4C5 ABC3D4E5 -244.71 9.59 -6.79 -2.1 2
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7588 73456 1 NO6C18H23 AB6C18D23 -187.85 4.2 -9.17 -0.15 0
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7589 73457 1 FeN6O15C39H57 AB6C15D39E57 -559.29 4.51 0.0 0.0 0
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7590 73458 3 N2O5C13H19 A2B5C13D19 -534.53 14.65 0.0 0.0 -3
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7591 73459 1 NNaS2C9H18 ABC2D9E18 -52.54 5.2 -7.99 0.2 0
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7592 73461 2 SN2O3C12H18 AB2C3D12E18 -251.15 1.36 -9.21 -1.42 0
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7593 73462 2 ClO2N3H17C18 AB2C3D17E18 -24.73 2.34 -8.51 -1.54 0
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7594 73463 6 NOC6H6 ABC6D6 -66.92 3.13 -8.91 -1.56 0
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7595 73464 1 O3N5C14H17 A3B5C14D17 -60.02 2.45 -9.59 -0.38 0
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7596 73467 1 O10C17H24 A10B17C24 -433.47 4.69 -9.9 -0.4 0
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7597 73468 1 O9C28H28 A9B28C28 -310.23 9.55 -8.21 -1.43 0
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7598 73469 1 ClNO2C16H18 ABC2D16E18 -61.86 6.17 -9.09 -0.66 0
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7599 73470 1 NO2C16H17 AB2C16D17 -26.87 3.07 -8.9 -0.51 0
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7600 73471 1 ClNO2C19H22 ABC2D19E22 -74.39 1.65 -8.98 -0.74 0
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7601 73472 1 NO2C19H21 AB2C19D21 -39.09 3.34 -8.89 -0.51 0
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7602 73473 1 ClNO3C21H24 ABC3D21E24 -92.16 3.98 -8.65 -0.03 0
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7603 73475 1 NSO8C22H25 ABC8D22E25 -265.83 7.55 -8.44 -0.07 0
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7604 73476 1 NO5C21H21 AB5C21D21 -118.24 6.98 -8.51 -0.07 0
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7605 73477 1 O2H14C15 A2B14C15 -38.22 4.05 -8.82 -0.48 0
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7606 73483 1 N2O5C6H8 A2B5C6D8 -122.59 6.87 -10.14 -1.07 0
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7607 73484 2 NC8H9 AB8C9 44.92 2.7 -8.15 0.26 0
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7608 73488 1 N4O6C17H22 A4B6C17D22 -173.74 5.3 -8.97 -1.68 0
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7609 73489 1 N2O2C21H26 A2B2C21D26 -9.66 3.03 -8.16 0.0 0
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7610 73490 1 NCl2O3H11C17 AB2C3D11E17 -77.45 2.61 -9.61 -1.96 0
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7611 73491 1 PNa2C3O4H5 AB2C3D4E5 -266.35 1.73 -8.22 0.93 0
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7612 73492 1 NO9C28H37 AB9C28D37 -344.33 2.51 -8.61 -0.1 0
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7613 73493 1 O3C31H50 A3B31C50 -206.49 3.39 -9.61 0.94 0
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7614 73494 1 NO7C8H13 AB7C8D13 -305.09 6.45 -10.47 -0.78 0
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7615 73498 1 O3C30H52 A3B30C52 -230.63 3.76 -9.74 2.26 0
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7616 73499 1 O5C20H34 A5B20C34 -192.65 3.48 -9.34 -0.05 0
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7617 73500 1 N4O5C18H20 A4B5C18D20 -67.85 3.28 -9.19 -1.85 0
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7618 73510 1 FNO2H10C16 ABC2D10E16 -30.72 1.75 -9.66 -1.38 0
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7619 73514 1 O3N8C10H12 A3B8C10D12 14.11 1.79 -9.18 -0.68 0
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7620 73515 1 O3N4C9H14 A3B4C9D14 -107.65 5.34 -9.62 -0.44 0
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7621 73521 1 ClON3C15H16 ABC3D15E16 18.14 4.39 -8.32 -1.04 0
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7622 73525 1 N2O3H14C17 A2B3C14D17 -29.44 1.77 -9.57 -0.72 0
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7623 73528 1 O7C30H42 A7B30C42 -312.51 4.88 -9.21 -0.5 0
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7624 73548 2 O2C10H11 A2B10C11 -110.35 2.56 -8.25 0.0 0
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7625 73553 1 NO11C34H35 AB11C34D35 -383.5 5.9 -8.8 -1.82 0