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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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353385 127284761 1 N2S3O4C15H22 A2B3C4D15E22 -139.99 7.45 -8.44 -0.97 0
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353386 127284762 1 SN3O4C17H27 AB3C4D17E27 -176.41 5.45 -8.8 -0.15 0
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353387 127284763 1 SO2N5C19H27 AB2C5D19E27 -31.63 7.36 -8.46 -0.23 0
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353388 127284764 1 SO2N3C16H23 AB2C3D16E23 -52.35 4.65 -8.62 0.19 0
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353389 127284765 1 SN3O3C18H31 AB3C3D18E31 -168.15 1.73 -8.75 0.34 0
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353390 127284766 1 SN3O3C20H27 AB3C3D20E27 -97.36 6.95 -8.7 -0.34 0
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353391 127284767 1 SN2O3C19H32 AB2C3D19E32 -173.72 1.41 -8.74 0.36 0
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353392 127284768 1 SO2N4C18H22 AB2C4D18E22 -11.58 5.45 -9.09 -1.32 0
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353393 127284769 1 SO2N3C18H23 AB2C3D18E23 -41.84 5.09 -8.97 -0.79 0
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353394 127284770 1 SN2O4C19H24 AB2C4D19E24 -152.19 3.2 -8.81 -0.81 0
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353395 127284771 1 FSN3O4C18H24 ABC3D4E18F24 -199.89 6.04 -9.42 -0.83 0
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353396 127284772 1 FSN3O4C17H22 ABC3D4E17F22 -199.28 7.47 -9.66 -0.87 0
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353397 127284773 1 FSN3O3C19H28 ABC3D3E19F28 -163.09 5.54 -8.58 -1.16 0
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353398 127284774 1 O2N4C21H22 A2B4C21D22 -37.32 5.54 -9.22 -0.98 0
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353399 127284775 1 O2N3C13H23 A2B3C13D23 -104.43 1.85 -8.85 0.58 0
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353400 127284776 1 SN3O3C20H31 AB3C3D20E31 -120.34 1.53 -8.79 -0.8 0
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353401 127284777 1 SN3O3C20H31 AB3C3D20E31 -116.87 3.93 -8.89 -0.99 0
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353402 127284778 1 N3O3C18H29 A3B3C18D29 -151.72 7.06 -8.72 -0.25 0
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353403 127284779 1 SN3O3C20H31 AB3C3D20E31 -122.52 6.53 -8.42 -0.57 0
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353404 127284780 1 O2N3C16H29 A2B3C16D29 -115.02 4.72 -8.67 0.67 0
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353405 127284781 2 ON2C11H15 AB2C11D15 -72.91 6.13 -8.78 -0.93 0
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353406 127284782 1 SN2O3C14H26 AB2C3D14E26 -156.07 6.81 -8.95 0.78 0
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353407 127284783 1 O3N4C14H24 A3B4C14D24 -132.31 5.3 -8.7 -0.2 0
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353408 127284784 1 SO2N4C19H26 AB2C4D19E26 -71.6 5.2 -8.83 -1.12 0
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353409 127284785 1 O3N4C17H24 A3B4C17D24 -92.98 4.28 -8.6 -0.99 0
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353410 127284786 1 SN3O3C18H27 AB3C3D18E27 -112.54 7.85 -8.59 -0.19 0
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353411 127284787 1 S2N3O3C18H29 A2B3C3D18E29 -116.43 3.15 -8.74 -1.22 0
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353412 127284788 1 O2N4C19H28 A2B4C19D28 -30.07 8.85 -9.23 -1.02 0
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353413 127284789 1 SN3O3C18H27 AB3C3D18E27 -110.79 6.57 -8.78 -0.18 0
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353414 127284790 2 ON3C8H12 AB3C8D12 -34.22 1.37 -8.88 -0.73 0
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353415 127284791 1 SN3O3C20H31 AB3C3D20E31 -118.91 4.36 -8.87 -0.38 0
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353416 127284792 1 SO2N3C19H29 AB2C3D19E29 -75.88 1.38 -8.8 -0.83 0
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353417 127284793 1 SN3O3C20H31 AB3C3D20E31 -117.7 4.51 -8.65 -0.88 0
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353418 127284794 1 S2N3O3C18H29 A2B3C3D18E29 -114.11 6.62 -8.57 -0.95 0
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353419 127284795 1 SO2N3C19H25 AB2C3D19E25 -69.2 3.06 -8.79 -0.51 0
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353420 127284796 1 SN3O4C19H29 AB3C4D19E29 -147.3 3.84 -8.73 -0.96 0
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353421 127284797 2 ON2C10H16 AB2C10D16 -80.15 4.19 -8.68 -0.33 0
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353422 127284798 1 S2N3O3C18H29 A2B3C3D18E29 -105.85 8.89 -8.49 -1.22 0
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353423 127284799 1 SN3O3C14H27 AB3C3D14E27 -142.95 6.3 -8.86 0.72 0
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353424 127284800 1 SN3O3C13H25 AB3C3D13E25 -138.92 3.93 -8.74 0.04 0
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353425 127284801 1 N2O3C16H22 A2B3C16D22 -95.01 3.5 -8.72 -0.73 0
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353426 127284802 1 FON4C16H21 ABC4D16E21 -50.93 6.18 -8.62 -1.08 0
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353427 127284803 1 SO2N3C15H25 AB2C3D15E25 -101.52 2.06 -8.7 -0.3 0
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353428 127284804 1 O2N4C19H28 A2B4C19D28 -30.36 8.4 -9.22 -0.98 0
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353429 127284805 1 ON4C19H32 AB4C19D32 -38.96 5.48 -8.84 0.35 0
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353430 127284806 1 SO2N3C15H27 AB2C3D15E27 -104.47 1.6 -8.82 -0.32 0
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353431 127284807 1 SO2N4C20H32 AB2C4D20E32 -95.26 4.32 -9.04 -0.39 0
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353432 127284808 1 OSN4C20H30 ABC4D20E30 -19.78 5.04 -9.05 -0.23 0
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353433 127284992 2 ON2C9H15 AB2C9D15 -77.65 7.03 -9.01 0.14 0
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353434 127284993 1 SO2N5C18H25 AB2C5D18E25 -19.92 6.95 -8.96 -0.92 0