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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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183590 77043982 1 FON3C16H18 ABC3D16E18 -3.0 4.43 -9.07 0.0 0
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183591 77043983 1 O2N3C14H23 A2B3C14D23 -30.9 1.05 -8.98 0.35 0
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183592 77043984 1 OF2N3C15H15 AB2C3D15E15 -47.69 3.34 -8.68 -0.28 0
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183593 77043985 1 ON3C17H21 AB3C17D21 24.92 2.41 -8.15 0.0 0
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183594 77044124 1 ON3C15H25 AB3C15D25 0.0 0.42 -8.53 0.38 0
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183595 77044125 1 O2N3C16H25 A2B3C16D25 -40.2 1.82 -8.76 0.26 0
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183596 77044350 1 ClFON4H12C13 ABCD4E12F13 -16.52 0.61 -9.8 -1.11 0
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183597 77044359 1 SO3N4C13H14 AB3C4D13E14 -28.42 5.46 -10.31 -0.9 0
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183598 77044360 1 OSN4C11H12 ABC4D11E12 43.53 2.57 -9.43 -1.16 0
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183599 77044361 1 SO4N6C10H18 AB4C6D10E18 -104.08 4.18 -9.87 -0.32 0
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183600 77044362 1 ON6C13H18 AB6C13D18 35.99 4.24 -9.11 -0.3 0
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183601 77044363 1 ON6C14H18 AB6C14D18 46.62 5.32 -8.74 -0.21 0
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183602 77044364 2 O2N3C5H7 A2B3C5D7 -55.31 1.21 -10.3 -0.98 0
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183603 77044365 1 OCl2N4H12C13 AB2C4D12E13 20.96 1.88 -9.69 -1.14 0
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183604 77044366 1 O3N5C11H17 A3B5C11D17 -108.37 5.27 -10.2 -0.16 0
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183605 77044489 1 O2N4C13H18 A2B4C13D18 -17.06 2.65 -9.31 -0.55 0
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183606 77044490 3 NOC5H7 ABC5D7 -72.11 3.35 -8.89 -0.3 0
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183607 77044491 1 O2N3C12H23 A2B3C12D23 -81.46 3.19 -8.81 0.74 0
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183608 77044492 1 O2N3C15H29 A2B3C15D29 -92.48 1.56 -9.32 0.4 0
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183609 77044528 1 SN3O3C10H23 AB3C3D10E23 -120.81 4.48 -8.88 0.26 0
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183610 77044529 1 O2N3C16H25 A2B3C16D25 -35.47 4.96 -8.62 0.18 0
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183611 77044993 1 SN2O3C13H20 AB2C3D13E20 -92.46 3.28 -8.9 0.04 0
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183612 77045125 1 SO3N4C10H22 AB3C4D10E22 -100.93 4.47 -8.85 0.39 0
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183613 77045289 1 SO2N4C12H20 AB2C4D12E20 -38.34 1.94 -8.79 -0.74 0
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183614 77045348 1 S2N3O3C10H11 A2B3C3D10E11 -35.11 3.4 -9.89 -1.25 0
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183615 77045709 1 BrON4C14H15 ABC4D14E15 40.96 5.19 -9.36 -0.42 0
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183616 77045710 1 BrOSN4C12H13 ABCD4E12F13 52.18 6.09 -9.34 -1.03 0
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183617 77045711 1 O2N6C9H14 A2B6C9D14 -35.23 8.72 -9.71 0.02 0
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183618 77045746 1 ClON4C14H15 ABC4D14E15 29.54 4.26 -9.33 -0.46 0
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183619 77045747 1 FON4C14H15 ABC4D14E15 -8.58 6.42 -9.4 -0.68 0
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183620 77045748 1 SO3N4C13H14 AB3C4D13E14 -20.03 5.28 -10.31 -0.88 0
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183621 77045806 1 ON6C14H18 AB6C14D18 58.0 5.97 -8.66 -0.47 0
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183622 77045848 1 ON5C12H13 AB5C12D13 58.9 1.78 -9.94 -1.17 0
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183623 77045849 1 OSN4C11H12 ABC4D11E12 52.94 1.89 -9.45 -1.15 0
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183624 77045850 1 O2N5C14H21 A2B5C14D21 -49.64 4.19 -10.0 -0.07 0
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183625 77045851 2 O2N3C5H7 A2B3C5D7 -48.07 5.0 -10.13 -0.73 0
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183626 77046091 1 NO2C17H21 AB2C17D21 -13.34 6.08 -9.17 -0.84 0
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183627 77046358 1 O2N5C13H15 A2B5C13D15 9.13 0.65 -9.12 -0.06 0
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183628 77046476 1 NOC17H25 ABC17D25 -29.12 1.3 -9.21 0.17 1
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183629 77046477 1 O2N5C10H18 A2B5C10D18 -38.35 2.53 0.0 0.0 0
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183630 77046478 1 O2N3C8H19 A2B3C8D19 -69.16 1.31 -9.07 0.61 0
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183631 77046479 1 O2N3C9H21 A2B3C9D21 -71.57 3.26 -9.09 0.62 0
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183632 77046480 2 ON2C6H10 AB2C6D10 5.3 2.17 -8.59 -1.75 0
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183633 77046964 1 SN3O3C14H15 AB3C3D14E15 -28.64 2.88 -9.15 -0.87 0
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183634 77047098 1 OF2N3H9C12 AB2C3D9E12 -52.96 6.65 -9.73 -1.67 0
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183635 77047152 1 BrNO4C14H16 ABC4D14E16 -129.02 6.66 -9.53 -1.35 0
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183636 77047153 1 N3O4C12H15 A3B4C12D15 -117.05 6.62 -10.01 -1.71 0
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183637 77047154 1 OF2N2H10C13 AB2C2D10E13 -54.17 4.97 -9.81 -1.68 0
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183638 77047155 1 OF2N2C14H18 AB2C2D14E18 -138.53 3.12 -9.75 -0.52 0
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183639 77047156 1 OF2N2H12C14 AB2C2D12E14 -77.06 4.5 -9.87 -1.09 0