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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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195545 78698754 3 NOC6H9 ABC6D9 -114.08 3.79 -8.18 0.05 0
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195546 78698783 1 O2N3C22H27 A2B3C22D27 -40.47 3.23 -8.02 0.17 0
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195547 78699186 1 N2O2C21H26 A2B2C21D26 -72.53 4.77 -8.6 0.03 0
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195548 78699187 1 NO2F5H12C19 AB2C5D12E19 -234.92 4.8 -8.97 -1.61 0
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195549 78699188 1 FSN3H14C17 ABC3D14E17 74.34 2.03 -8.51 -0.78 0
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195550 78699266 1 NF3O3H12C18 AB3C3D12E18 -166.47 3.91 -9.32 -1.17 1
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195551 78699596 1 F3N3O3C21H29 A3B3C3D21E29 -275.23 8.26 0.0 0.0 0
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195552 78699597 1 F3N3O3C21H28 A3B3C3D21E28 -279.44 6.48 -8.55 -0.26 0
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195553 78699957 1 SO3C19H20 AB3C19D20 -71.72 5.56 -9.44 -1.16 0
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195554 78699958 1 SO3F5H9C16 AB3C5D9E16 -269.27 5.52 -10.5 -1.72 0
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195555 78699959 1 SO4C18H18 AB4C18D18 -100.02 4.28 -9.09 -0.99 0
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195556 78699960 1 SO4H14C16 AB4C14D16 -96.67 6.5 -9.47 -1.31 0
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195557 78700491 1 FNO4C24H30 ABC4D24E30 -219.84 5.29 -8.99 -0.16 0
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195558 78700492 1 N3O5C22H33 A3B5C22D33 -264.14 4.41 -9.76 -0.31 0
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195559 78700553 1 O3N4C19H30 A3B4C19D30 -116.9 1.97 -8.44 0.13 0
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195560 78700760 1 SO3N4C21H22 AB3C4D21E22 -46.95 3.12 -8.43 -0.48 0
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195561 78701236 1 F2N4O5C18H22 A2B4C5D18E22 -307.55 3.52 -9.4 -0.29 1
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195562 78701470 1 ON3C16H24 AB3C16D24 15.67 2.93 0.0 0.0 0
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195563 78701673 1 FSN4O4C18H25 ABC4D4E18F25 -187.24 7.18 -8.7 -0.82 0
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195564 78701717 1 N3O7C17H23 A3B7C17D23 -208.08 9.01 -9.42 -1.08 0
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195565 78701793 1 SF2N2O2C22H22 AB2C2D2E22F22 -112.67 5.73 -9.02 -0.33 1
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195566 78702372 1 ClN2O4C22H26 AB2C4D22E26 -99.42 6.92 0.0 0.0 1
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195567 78702405 1 OSN2C18H21 ABC2D18E21 15.0 2.89 0.0 0.0 0
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195568 78702406 1 ClFN2O4C17H18 ABC2D4E17F18 -168.26 5.92 -9.27 -0.62 1
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195569 78702407 1 N2S2C16H17 A2B2C16D17 92.87 4.94 0.0 0.0 1
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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