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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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86429 49885437 1 SO3N4C26H30 AB3C4D26E30 -27.83 2.62 -8.78 -0.26 0
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86430 49885456 1 S2N4O7C25H26 A2B4C7D25E26 -186.89 4.42 -9.12 -1.29 0
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86431 49885462 1 SN4O4C23H24 AB4C4D23E24 -58.52 6.6 -8.73 -0.89 0
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86432 49885468 1 SN3O3C23H23 AB3C3D23E23 -5.35 2.82 -8.78 -0.75 0
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86433 49885481 1 SO3N4H22C24 AB3C4D22E24 19.53 3.35 -8.76 -0.72 0
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86434 49885482 1 SN3O3C24H25 AB3C3D24E25 -13.6 3.41 -8.77 -0.69 0
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86435 49885484 1 SN3O4C23H25 AB3C4D23E25 -39.14 5.07 -8.42 -0.15 0
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86436 49885485 1 SN3O3C25H29 AB3C3D25E29 -22.51 5.99 -8.54 0.02 0
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86437 49885500 1 SN3O3C24H27 AB3C3D24E27 -22.74 4.24 -8.77 -0.12 0
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86438 49885554 1 SO3N4C20H26 AB3C4D20E26 -52.85 4.42 -8.99 -0.6 0
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86439 49885556 1 ClSO3N4C24H25 ABC3D4E24F25 -24.79 3.12 -8.88 -0.85 0
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86440 49885557 1 S2O3N5C25H25 A2B3C5D25E25 14.48 8.25 -9.07 -0.89 0
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86441 49885580 1 SF3O3N4C25H25 AB3C3D4E25F25 -176.21 5.77 -9.05 -0.77 0
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86442 49885581 1 SCl2O3N4C24H24 AB2C3D4E24F24 -31.32 4.6 -8.86 -1.05 0
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86443 49885584 1 S2O3N6C24H30 A2B3C6D24E30 -5.89 0.82 -8.91 -0.97 0
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86444 49885587 1 S2O3N4H26C28 A2B3C4D26E28 25.21 4.41 -8.59 -0.68 0
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86445 49885588 1 S2N4O5H28C29 A2B4C5D28E29 -76.87 3.67 -8.7 -1.09 -1
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86446 49885628 1 ClNO2C23H41 ABC2D23E41 -105.88 4.68 0.0 0.0 0
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86447 49885643 1 ClSO3N4H27C28 ABC3D4E27F28 -20.42 6.56 -8.75 -0.98 0
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86448 49885651 1 S2N5O5H25C26 A2B5C5D25E26 -74.72 3.76 -8.8 -0.9 0
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86449 49885652 1 SN3O3C27H27 AB3C3D27E27 5.01 4.28 -8.7 -0.58 0
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86450 49885711 1 SN4O5C28H28 AB4C5D28E28 -74.43 7.87 -8.41 -0.65 0
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86451 49885723 1 SO3N7H23C25 AB3C7D23E25 58.21 10.53 -8.8 -1.04 0
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86452 49885725 1 ClSO3N4H21C25 ABC3D4E21F25 3.72 4.92 -8.91 -1.1 0
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86453 49885726 1 ClSO3N4H23C26 ABC3D4E23F26 -9.78 5.76 -8.89 -1.04 0