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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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190119 77957066 1 ClSN3O4C27H32 ABC3D4E27F32 -128.74 1.53 -8.59 -0.22 0
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190120 77957148 1 ON2C33H40 AB2C33D40 109.49 6.13 -8.32 -0.01 0
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190121 77957342 1 ClSN3O6H20C24 ABC3D6E20F24 -66.63 6.62 -9.13 -1.79 0
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190122 77957575 1 O3C17H22 A3B17C22 -119.67 2.78 -9.68 0.0 0
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190123 77957786 1 FN3O5C26H26 AB3C5D26E26 -182.86 3.91 -8.86 -1.02 0
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190124 77957991 1 N2O5C22H28 A2B5C22D28 -37.42 3.7 -7.01 -0.17 0
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190125 77957992 2 NOC8H10 ABC8D10 -8.06 1.31 -8.6 -0.01 0
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190126 77957993 1 OSN4C20H20 ABC4D20E20 55.9 8.0 -9.57 -1.31 0
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190127 77958709 1 FSN3O3C21H36 ABC3D3E21F36 -190.53 6.18 -8.2 0.11 0
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190128 77959005 1 N5O5C39H47 A5B5C39D47 -177.71 5.39 -8.39 -0.76 0
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190129 77959076 1 FNO7C21H28 ABC7D21E28 -357.29 2.27 -9.09 -0.15 0
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190130 77959081 1 NO4C27H51 AB4C27D51 -272.67 5.95 -9.77 0.51 0
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190131 77959082 1 N2O3C17H24 A2B3C17D24 -99.24 4.68 -9.17 -0.07 0
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190132 77959352 1 ClFN2S2O4H14C15 ABC2D2E4F14G15 -156.69 5.01 -8.84 -1.12 0
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190133 77959459 1 ON6H24C30 AB6C24D30 143.67 3.92 -9.22 -1.25 0
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190134 77959632 1 NO3H17C20 AB3C17D20 -30.76 7.07 -9.35 -1.32 0
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190135 77959751 1 SN4O5C38H48 AB4C5D38E48 -135.95 6.38 -8.4 -0.05 1
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190136 77959925 1 N7C25H30 A7B25C30 135.42 11.44 0.0 0.0 0
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190137 77959926 1 NSO2C9H17 ABC2D9E17 -86.24 4.32 -9.9 0.59 0
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190138 77959927 1 N2O3C16H16 A2B3C16D16 1.01 10.07 -7.77 -1.65 0
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190139 77959928 1 O2N4H24C25 A2B4C24D25 13.95 4.28 -9.15 -0.78 0
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190140 77959929 2 ON2C11H12 AB2C11D12 2.3 3.19 -9.43 -0.5 0
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190141 77959930 1 O3N4C21H24 A3B4C21D24 -58.58 1.76 -9.28 -0.49 0
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190142 77959931 1 ON2C12H22 AB2C12D22 -82.39 3.64 -9.21 1.38 0
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190143 77959932 2 ON2C10H11 AB2C10D11 -21.46 3.1 -9.39 -0.52 0
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190144 77959933 2 N2C7H12 A2B7C12 17.59 5.78 -8.77 0.99 0
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190145 77959934 1 ON4C13H24 AB4C13D24 -57.94 5.09 -9.13 0.93 0
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190146 77959935 1 BNOC16H17 ABCD16E17 25.41 7.26 0.0 0.0 0
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190147 77959936 1 BO2N3H37C42 AB2C3D37E42 121.66 3.9 0.0 0.0 0
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190148 77959937 1 ClF3N3O4C31H33 AB3C3D4E31F33 -239.08 7.66 -9.34 -1.0 0
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190149 77959938 2 NOC26H28 ABC26D28 61.85 4.64 -7.88 -2.1 0
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190150 77959939 1 N4O8C19H32 A4B8C19D32 -396.76 3.04 -9.95 0.12 0
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190151 77959940 1 ON2C14H24 AB2C14D24 -69.86 4.27 -8.79 1.26 0
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190152 77959941 1 OC17H22 AB17C22 -29.2 3.03 -9.2 -0.41 0
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190153 77959942 1 ICl2N3O3C29H32 AB2C3D3E29F32 -75.29 5.39 -9.46 -1.13 0
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190154 77959943 1 Cl2O2F3N3C30H34 A2B2C3D3E30F34 -212.38 7.31 -8.57 -1.25 0
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190155 77959944 1 BNO5H33C34 ABC5D33E34 -87.14 2.68 0.0 0.0 0
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190156 77959945 1 N2O5C31H36 A2B5C31D36 -188.99 4.66 -8.73 -0.06 0
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190157 77959946 1 O3C31H48 A3B31C48 -202.34 8.32 -9.61 0.04 0
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190158 77959947 1 O4C29H44 A4B29C44 -216.59 12.12 -9.73 -0.45 0
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190159 77959948 1 O3C29H46 A3B29C46 -188.29 6.26 -9.19 0.95 0
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190160 77959949 1 NO4C27H27 AB4C27D27 -117.91 4.18 -9.07 -0.49 0
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190161 77959950 1 BNO3C26H29 ABC3D26E29 -27.56 2.39 0.0 0.0 0
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190162 77959951 1 BNO5H31C33 ABC5D31E33 -81.43 2.99 0.0 0.0 0
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190163 77960131 1 NO3C22H31 AB3C22D31 -64.86 2.55 -9.74 -0.74 0
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190164 77960449 1 O4C13H18 A4B13C18 -179.93 5.64 -9.26 -0.17 0
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190165 77960450 1 ClNO4C28H32 ABC4D28E32 -143.09 5.79 -9.39 -0.85 0
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190166 77960451 1 NF2S2O4C23H27 AB2C2D4E23F27 -232.94 9.11 -9.79 -0.86 0
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190167 77960673 4 OC5H7 AB5C7 -175.6 2.56 -9.49 0.27 0
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190168 77960674 1 NO4C25H39 AB4C25D39 -208.6 2.53 -9.38 0.37 0