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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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230882 87572194 1 NSi2C15H24 AB2C15D24 49.7 0.62 0.0 0.0 0
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230883 87572195 1 NSi2C15H35 AB2C15D35 -94.7 0.99 -7.48 0.43 0
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230884 87572196 1 NSi2C14H33 AB2C14D33 -72.04 1.6 -7.76 1.09 0
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230885 87572197 1 NSi2C15H35 AB2C15D35 -83.83 1.31 -8.12 0.74 0
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230886 87572198 1 NSi2C14H33 AB2C14D33 -81.56 1.43 -7.76 0.71 0
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230887 87572200 1 NSi2C15H32 AB2C15D32 1.35 3.16 0.0 0.0 0
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230888 87572202 1 NSi2C15H34 AB2C15D34 -44.47 2.19 0.0 0.0 0
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230889 87572203 1 F2S2N3O4C25H25 A2B2C3D4E25F25 -146.89 5.45 -8.94 -1.12 0
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230890 87572205 1 FOSN2H7C9 ABCD2E7F9 -15.57 2.68 -8.93 -0.74 0
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230891 87572206 1 F2S2N4O4H22C25 A2B2C4D4E22F25 -132.11 7.16 -9.18 -1.34 0
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230892 87572212 1 BrO6N9C52H58 AB6C9D52E58 -141.62 3.01 -8.34 -0.5 1
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230893 87572213 1 N2C11H21 A2B11C21 4.32 2.56 0.0 0.0 0
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230894 87572216 1 O4C9H16 A4B9C16 -185.2 2.35 -10.25 0.22 0
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230896 87572219 1 O2C11H20 A2B11C20 -90.54 1.8 -9.95 -0.08 0
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230897 87572220 2 ClO2S2N3F4H18C21 AB2C2D3E4F18G21 -410.86 2.95 -8.62 -1.57 0
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230898 87572221 1 OF6N7H17C18 AB6C7D17E18 -251.1 7.13 -9.01 -0.68 0
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230899 87572222 1 NaSO4H10C11 ABC4D10E11 -178.78 6.32 0.0 0.0 0
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230900 87572223 1 SN3F4O4H17C20 AB3C4D4E17F20 -249.24 4.38 -8.97 -1.07 0
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230901 87572224 1 ClSN3O3C16H16 ABC3D3E16F16 -68.77 11.63 -8.64 -0.98 0
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230902 87572225 2 SN2O2C11H12 AB2C2D11E12 -55.95 6.51 -9.31 -1.11 0
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230903 87572226 1 FSN3O3H16C18 ABC3D3E16F18 -89.33 7.49 -9.38 -1.58 0
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230904 87572227 1 PbO2C8H16 AB2C8D16 -43.31 3.96 -5.33 -1.42 0
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230905 87572228 1 FNOC13H18 ABCD13E18 -65.52 2.17 -9.06 -0.13 0
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230906 87572230 1 NO6C11H17 AB6C11D17 -232.31 1.94 -10.06 -0.69 0
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230907 87572231 2 FNSO4H11C14 ABCD4E11F14 -287.22 9.01 -9.18 -1.61 0
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230908 87572232 1 Cl2O5C11H18 A2B5C11D18 -246.59 6.45 -10.24 -0.36 0
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230909 87572234 1 O7C11H20 A7B11C20 -324.24 6.36 -9.76 -0.17 0
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230910 87572235 1 Cl2O5C10H14 A2B5C10D14 -242.04 1.88 -10.41 -0.7 0
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230911 87572237 1 ClO7C10H17 AB7C10D17 -348.16 7.64 -10.77 -0.32 0
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230912 87572238 1 O7C10H16 A7B10C16 -313.78 4.68 -10.58 -0.32 0
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230913 87572240 1 ClN2O8C49H53 AB2C8D49E53 -206.37 5.87 -8.85 -0.22 0
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230914 87572241 1 BrFN2O9C22H28 ABC2D9E22F28 -395.15 4.0 -9.46 -0.28 0
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230915 87572244 1 NSiO2C25H36 ABC2D25E36 -42.35 2.62 0.0 0.0 0
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230916 87572245 1 FN2O9C24H33 AB2C9D24E33 -409.6 2.73 -9.06 -0.43 0
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230917 87572247 1 NSiO2C25H36 ABC2D25E36 -47.79 4.17 0.0 0.0 0
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230918 87572248 1 S2N4O4C23H26 A2B4C4D23E26 -60.22 1.29 -9.03 -1.09 0
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230919 87572249 1 SN2O2F3C9H11 AB2C2D3E9F11 -200.95 3.73 -9.48 -0.9 0
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230920 87572250 1 N9O9C53H61 A9B9C53D61 -253.5 3.9 -7.92 -1.54 0
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230921 87572251 1 SN2O2F3C9H11 AB2C2D3E9F11 -201.93 4.8 -9.28 -0.78 0
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230922 87572252 1 N9O9C53H65 A9B9C53D65 -320.97 6.81 -7.96 -0.14 0
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230923 87572254 2 SN3O4F7H20C21 AB3C4D7E20F21 -936.87 10.03 -9.08 -1.36 0
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230924 87572255 1 FO6N10C49H63 AB6C10D49E63 -243.12 8.07 -8.08 -0.44 0
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230925 87572257 1 SO3F4N4C23H24 AB3C4D4E23F24 -207.8 6.73 -8.51 -1.05 0
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230926 87572260 1 SCl2N4O5C27H46 AB2C4D5E27F46 -298.79 10.26 -8.55 -0.38 0
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230927 87572262 1 Cl3N4C15H19 A3B4C15D19 2.96 7.81 -9.11 -0.97 0
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230928 87572264 1 ClSN3O3C22H24 ABC3D3E22F24 -42.58 2.08 -9.04 -1.38 0
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230929 87572265 1 BrNC9H22 ABC9D22 -76.89 8.32 -9.13 1.58 0
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230930 87572270 1 N3O4C20H29 A3B4C20D29 -187.71 4.03 -8.92 -0.21 0
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230931 87572274 1 SN4O5C25H28 AB4C5D25E28 -139.88 7.35 -8.69 -0.81 0
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230932 87572276 1 N2O2C49H94 A2B2C49D94 -260.41 5.72 -9.02 1.17 0