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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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400845 135049222 1 HSbC2Cl2 ABC2D2 -1.11 3.82 -10.15 -0.87 0
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400846 135049223 1 O3C20H30 A3B20C30 -95.92 2.84 -9.1 1.16 0
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400848 135049273 1 FNSiC22H50 ABCD22E50 -138.26 16.2 -6.93 -0.36 -1
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400849 135049274 1 FSiC6H14 ABC6D14 -101.84 2.17 0.0 0.0 0
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400850 135049275 1 PSnO4C25H45 ABC4D25E45 -243.97 2.97 -8.64 0.24 0
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400851 135049276 1 PbO3F4H18C26 AB3C4D18E26 -172.3 3.61 -8.96 -1.05 0
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400852 135049277 1 PbS2O4C6H10 AB2C4D6E10 -203.39 1.88 -9.05 -1.53 0
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400853 135049278 1 LiPbSeH15C18 ABCD15E18 -116.54 13.57 -7.76 -0.47 1
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400854 135049279 1 Si2O4N5C23H34 A2B4C5D23E34 -196.78 3.25 0.0 0.0 0
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400855 135049280 4 C4H5 A4B5 37.69 1.0 -8.95 -0.13 0
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400856 135049290 1 GeCo2O7C15H20 AB2C7D15E20 -352.75 37.68 -10.3 -5.98 0
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400857 135049291 1 SeN2O6C29H32 AB2C6D29E32 -121.87 4.08 -8.51 -0.55 0
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400858 135049293 1 GeC17H21 AB17C21 26.05 0.67 0.0 0.0 0
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400859 135049294 1 SCl2N2O5H22C23 AB2C2D5E22F23 -145.26 6.87 -9.13 -0.97 0
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400860 135049295 1 BSnC26H51 ABC26D51 -75.85 0.45 -8.48 0.65 0
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400861 135049296 1 NaVO10C14H20 ABC10D14E20 -286.39 26.14 -6.13 -2.41 0
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400862 135049297 1 PbN2O2C7H14 AB2C2D7E14 -10.82 0.81 -9.34 -0.48 1
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400863 135049298 1 PbN2O2C7H15 AB2C2D7E15 6.43 3.05 0.0 0.0 0
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400865 135049300 1 SiLi2N2C10F12H12 AB2C2D10E12F12 -711.43 10.29 -9.09 -0.49 0
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400866 135049301 1 SiN2C10F12H14 AB2C10D12E14 -703.45 4.11 -10.21 -0.04 0
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400867 135049302 1 BO3C14H19 AB3C14D19 -165.56 1.05 -9.4 0.2 0
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400868 135049304 1 N2P3C13O15H17 A2B3C13D15E17 -801.95 11.92 -10.67 -1.29 0
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400869 135049305 1 BBrPO2C20H37 ABCD2E20F37 -208.69 7.85 -9.19 -0.07 0
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400870 135049306 1 BNC2Cl3H7 ABC2D3E7 -140.58 8.22 -10.39 -0.41 -1
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400871 135049307 1 BNC2Cl3H6 ABC2D3E6 -108.89 8.34 0.0 0.0 0
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400872 135049308 2 LiN2C16H27 AB2C16D27 9.75 12.01 -6.98 1.66 0
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400873 135049309 1 BNCl3C6H15 ABC3D6E15 -163.7 8.79 -9.99 -0.19 -1
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400874 135049310 1 BNCl3C6H14 ABC3D6E14 -133.89 8.58 0.0 0.0 0
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400875 135049312 1 BClNO3C20H29 ABCD3E20F29 -165.5 6.65 -9.45 -0.28 0
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400876 135049313 1 BOC26H53 ABC26D53 -187.95 1.31 -9.22 0.99 0
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400877 135049314 1 BOC26H45 ABC26D45 -127.8 0.97 -9.15 0.08 0
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400878 135049315 1 BOSC31H59 ABCD31E59 -196.06 1.36 -8.71 0.28 0
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400879 135049319 1 BN2S2O6F12H31C42 AB2C2D6E12F31G42 -795.12 3.7 -9.31 -1.73 0
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400880 135049328 1 N2O4C23H30 A2B4C23D30 -161.24 2.69 -9.61 -0.02 0
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400881 135049329 1 BSnC17H33 ABC17D33 -34.05 0.62 -8.42 0.62 0
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400882 135049333 1 BC2H2Cl3 AB2C2D3 -57.58 2.23 -10.48 -1.02 0
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400883 135049334 1 BFNSi4C17H45 ABCD4E17F45 -284.01 1.34 -8.31 1.4 0
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400884 135049336 1 INO3H26C27 ABC3D26E27 -31.14 4.29 -8.74 -0.66 0
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400885 135049339 1 BOC29H51 ABC29D51 -144.64 1.41 -9.29 0.11 0
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400886 135049343 1 BN2S2O6F12H29C40 AB2C2D6E12F29G40 -805.49 2.92 -9.33 -1.72 0
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400887 135049344 1 BO3C23H39 AB3C23D39 -184.27 3.57 -8.65 0.31 0
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400888 135049345 1 BN2S2O6F12H43C44 AB2C2D6E12F43G44 -870.83 4.91 -8.75 -1.72 0
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400889 135049347 1 BSO2C35H59 ABC2D35E59 -192.39 2.57 -8.32 0.04 0
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400890 135049349 1 BOSC28H53 ABCD28E53 -177.77 2.81 -8.8 0.2 0
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400891 135049350 1 BClOSC28H52 ABCDE28F52 -186.84 3.43 -8.86 -0.07 0
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400893 135049354 1 SnO2C24H44 AB2C24D44 -113.83 1.83 -9.1 0.32 0
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400894 135049377 1 OSiSnC20H46 ABCD20E46 -164.12 1.6 -9.05 0.7 0
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400895 135049378 1 OSiSnC26H58 ABCD26E58 -182.98 1.62 -8.58 0.72 0
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400896 135049412 1 NSi2O7C46H81 AB2C7D46E81 -415.85 6.38 -8.39 -0.41 0
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400897 135049413 1 OSSiC19H32 ABCD19E32 -103.93 1.41 -8.58 0.0 0