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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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195570 78702549 1 SN2O3C19H25 AB2C3D19E25 -50.15 7.32 0.0 0.0 0
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195571 78702927 1 ClO3N4H11C16 AB3C4D11E16 35.31 10.21 -9.09 -1.46 0
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195572 78703028 1 ClOSF2N5H14C17 ABCD2E5F14G17 -26.1 4.88 -9.13 -1.18 0
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195573 78703256 1 SN3O3C21H21 AB3C3D21E21 6.61 5.48 -9.29 -1.17 0
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195574 78703905 1 OSN2C18H22 ABC2D18E22 -4.56 6.48 -8.17 -0.29 0
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195575 78703906 1 SN2O2C18H22 AB2C2D18E22 -34.82 6.41 -8.19 -0.12 0
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195576 78704216 1 ON4C23H30 AB4C23D30 6.21 3.55 -7.96 0.32 0
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195577 78704285 1 OSN3C19H31 ABC3D19E31 -41.33 5.4 -8.38 0.03 0
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195578 78704286 2 NO2C10H12 AB2C10D12 -135.5 4.86 -8.4 -0.47 1
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195579 78704287 1 OF2S2N3C17H26 AB2C2D3E17F26 -104.77 5.48 0.0 0.0 0
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195580 78704288 1 OF2S2N3C17H25 AB2C2D3E17F25 -123.83 8.4 -8.75 -0.84 0
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195581 78704289 2 NOC7H11 ABC7D11 -85.99 2.81 -8.17 0.27 0
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195582 78704290 1 O3N4C18H24 A3B4C18D24 -83.99 7.64 -8.35 -0.49 1
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195583 78704291 1 OSN3C18H30 ABC3D18E30 -31.39 2.84 0.0 0.0 0
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195584 78704575 1 SO4N5C19H19 AB4C5D19E19 -9.71 7.56 -8.84 -1.86 1
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195585 78704851 1 ON2F3H20C22 AB2C3D20E22 -102.77 5.3 0.0 0.0 1
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195586 78704962 1 FOCl2N3H17C18 ABC2D3E17F18 -21.13 10.51 0.0 0.0 0
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195587 78705047 1 BrN3O3C18H20 AB3C3D18E20 -14.78 5.0 -9.31 -1.46 1
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195588 78705053 1 BrO2N3C19H23 AB2C3D19E23 -37.49 4.33 0.0 0.0 1
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195589 78705081 1 ClSN2O3C14H20 ABC2D3E14F20 -63.58 2.62 0.0 0.0 0
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195590 78705156 1 BrNSO3C17H18 ABCD3E17F18 -76.98 4.11 -9.27 -0.79 0
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195591 78705157 1 NSO2C19H21 ABC2D19E21 -53.41 6.32 -9.1 -0.38 1
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195592 78705459 1 N2O3C16H23 A2B3C16D23 -90.93 4.64 0.0 0.0 0
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195593 78707235 1 ClSF2N2O4H13C15 ABC2D2E4F13G15 -192.39 4.96 -9.24 -1.41 1
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195594 78707671 1 SN3O3C19H24 AB3C3D19E24 -46.42 0.79 0.0 0.0 1