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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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383610 134975418 1 TeO2C8H10 AB2C8D10 -50.56 5.45 -8.48 -0.38 0
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383611 134975423 1 N2O2C13H16 A2B2C13D16 -37.27 4.09 -8.94 -0.42 0
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383612 134975424 2 NC6H7 AB6C7 45.29 3.06 -9.17 0.38 0
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383613 134975425 1 BrIN2O2C8H10 ABC2D2E8F10 -33.15 2.71 -9.35 -1.4 0
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383614 134975426 1 OSeH12C13 ABC12D13 -17.71 3.4 -8.67 -0.62 0
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383615 134975427 1 LiN2C11H13 AB2C11D13 54.28 10.05 -7.02 1.31 0
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383616 134975428 1 SeF3O4C9H9 AB3C4D9E9 -334.1 6.24 -9.67 -1.61 0
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383617 134975429 1 ClS3O4C6H9 AB3C4D6E9 14.41 11.42 -9.17 -3.26 0
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383618 134975430 1 Cl2O2C11H12 A2B2C11D12 -92.83 3.96 -9.45 -0.61 0
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383619 134975431 1 NO2C15H19 AB2C15D19 -67.07 4.05 -8.06 -0.1 0
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383620 134975432 1 ClSO6C7H9 ABC6D7E9 -80.82 8.06 -9.38 -3.95 0
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383621 134975435 1 ClS2O4C9H9 AB2C4D9E9 26.38 7.24 -9.23 -4.46 0
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383622 134975436 1 NO4C13H13 AB4C13D13 -92.41 3.73 -9.76 -1.1 0
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383623 134975437 1 NOC15H19 ABC15D19 -11.85 2.48 -8.98 -0.19 0
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383624 134975438 1 SO2N3H9C10 AB2C3D9E10 -16.83 6.38 -8.78 -0.84 0
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383625 134975441 1 OSCl2N2H4C10 ABC2D2E4F10 49.4 3.64 -9.63 -1.69 0
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383626 134975442 1 NNa2S3H5C9 AB2C3D5E9 -14.37 11.12 -6.4 -0.51 0
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383627 134975443 1 SO2N4C11H20 AB2C4D11E20 33.11 9.84 -8.1 -0.8 0
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383628 134975444 1 O2N3C7H11 A2B3C7D11 -57.02 0.87 -8.95 -0.24 0
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383629 134975445 1 TeBr2O2H6C9 AB2C2D6E9 -59.84 7.31 -9.16 -2.59 0
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383630 134975446 1 TeO2H10C11 AB2C10D11 -52.21 1.93 -8.38 -1.16 0
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383631 134975448 2 NC7H7 AB7C7 48.76 7.1 -8.56 -0.36 0
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383632 134975451 1 OS2C10H12 AB2C10D12 -49.23 4.35 -8.16 -0.97 0
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383633 134975452 1 OS2H10C12 AB2C10D12 2.43 3.21 -8.42 -1.38 0
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383634 134975453 1 ClS3O5C8H9 AB3C5D8E9 -13.12 14.0 -10.01 -3.18 0
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383635 134975461 1 ClSN3C7H8 ABC3D7E8 24.06 3.53 -9.32 -1.02 0
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383636 134975462 1 NOSC13H15 ABCD13E15 0.57 4.51 -9.28 -0.43 0
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383637 134975464 1 SN2C8H10 AB2C8D10 69.4 3.46 -8.38 -0.49 0
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383638 134975470 2 SeH5C8 AB5C8 69.24 0.02 -8.55 -1.04 0
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383639 134975478 1 NS2H11C12 AB2C11D12 47.17 3.87 -8.09 -0.84 0
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383640 134975479 1 N2S3H12C13 A2B3C12D13 47.44 3.15 -8.49 -1.59 0
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383641 134975482 1 SN2O6C8H8 AB2C6D8E8 -137.07 8.19 -10.12 -1.85 0
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383642 134975483 1 BrSN2O4C7H7 ABC2D4E7F7 -58.54 3.34 -10.31 -2.24 0
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383643 134975485 1 NOSCl2C10H11 ABCD2E10F11 -22.76 2.98 -7.6 -1.49 0
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383644 134975493 1 ClNOH10C15 ABCD10E15 27.72 2.89 -8.91 -0.91 0
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383645 134975494 1 ClTeI2O2H5C9 ABC2D2E5F9 -34.91 6.65 -9.24 -3.12 0
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383646 134975495 1 ClS2H9C10 AB2C9D10 23.21 5.75 -8.87 -1.89 0
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383647 134975496 1 BrCl2S2H5C9 AB2C2D5E9 43.92 5.01 -9.23 -2.35 1
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383648 134975498 1 SF3O3H6C11 AB3C3D6E11 -220.57 2.06 0.0 0.0 0
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383649 134975499 1 LiON2C13H15 ABC2D13E15 -9.82 8.85 -7.76 0.34 0
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383650 134975500 1 NO2C14H17 AB2C14D17 -55.91 2.41 -8.37 0.13 0
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383651 134975501 1 FNSeS2O4C7H10 ABCD2E4F7G10 -174.96 4.16 -8.81 -1.22 0
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383652 134975502 1 H3N3O5C7 A3B3C5D7 47.7 6.08 -10.71 -2.68 0
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383653 134975503 1 S2N3O3C7H9 A2B3C3D7E9 -56.51 4.01 -8.91 -0.57 1
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383654 134975505 1 NO2S2F3C7H7 AB2C2D3E7F7 -212.9 5.48 0.0 0.0 0
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383655 134975506 1 SeN3C9H9 AB3C9D9 88.41 0.46 -8.36 -0.48 0
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383656 134975507 1 SeN3C12H15 AB3C12D15 68.51 3.06 -8.0 -0.19 0
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383657 134975509 2 SN2H5C6 AB2C5D6 125.77 4.58 -9.43 -1.8 0
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383658 134975511 1 AgClN2C5H6 ABC2D5E6 46.13 4.08 -8.12 -4.1 0
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383659 134975512 1 SeC10H10 AB10C10 18.57 1.84 -8.18 -0.17 0
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383660 134975513 1 ClOTeBr2H5C9 ABCD2E5F9 -10.39 5.7 -9.48 -2.44 0
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383661 134975514 1 NTeH9C14 ABC9D14 69.23 2.86 -7.8 -0.76 0
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383662 134975515 1 GeI2N8H16C32 AB2C8D16E32 463.31 12.5 -7.83 -2.97 0
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383663 134975516 1 S5C11H14 A5B11C14 26.21 3.49 -8.07 -1.81 0
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383664 134975517 1 ClNS2O4C8H12 ABC2D4E8F12 17.99 15.15 -8.56 -3.07 0
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383665 134975519 1 NOC14H17 ABC14D17 -27.49 5.95 -8.6 -0.28 0
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383666 134975520 1 OCl2N2S2H6C11 AB2C2D2E6F11 36.99 7.66 -9.58 -1.73 0
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383667 134975521 1 NSO2C10H17 ABC2D10E17 -92.17 4.03 -8.34 -0.26 0
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383668 134975522 1 N2O2F3H5C6 A2B2C3D5E6 -176.73 8.22 -10.14 -0.84 0
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383669 134975523 1 ClNSO3C8H8 ABCD3E8F8 -101.58 6.56 -10.04 -2.0 0
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383670 134975525 1 SN3O3C9H15 AB3C3D9E15 -23.16 7.7 -9.27 -1.63 0
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383671 134975526 1 ClOSN2C6H7 ABCD2E6F7 -22.45 2.35 -9.05 -0.65 0
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383672 134975527 1 ClISN2C10H12 ABCD2E10F12 22.59 5.08 -7.94 -1.21 0
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383675 134975534 1 AgBrN2C5H6 ABC2D5E6 55.47 3.83 -8.12 -4.06 0
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383676 134975535 1 N2O3C10H16 A2B3C10D16 -109.31 5.5 -9.16 -0.01 0
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383678 134975538 1 OTeBr2H6C8 ABC2D6E8 -27.78 2.57 -9.01 -2.28 0
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383679 134975539 2 ClSeH3C7 ABC3D7 42.87 0.62 -8.6 -1.05 0
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383680 134975541 1 TeO2Br3H5C9 AB2C3D5E9 -55.07 6.72 -9.68 -2.73 0
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383681 134975543 1 ClNOS2C13H14 ABCD2E13F14 -9.09 6.61 -8.4 -1.48 0
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383682 134975544 1 S3H10C12 A3B10C12 45.72 3.14 -8.36 -1.72 0
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383683 134975545 2 BrNOH2C4 ABCD2E4 39.23 6.42 -9.54 -1.49 1
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383684 134975546 1 O3H5C7 A3B5C7 -63.46 2.52 0.0 0.0 0
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383687 134975550 2 NC8H12 AB8C12 34.44 3.33 -9.32 -0.24 0
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383688 134975551 1 NO2C13H15 AB2C13D15 -35.65 0.6 -8.88 -0.38 0
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383689 134975552 1 NO3C13H13 AB3C13D13 -74.19 2.61 -9.9 -0.9 0