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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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222295 85296360 1 NO2C21H29 AB2C21D29 -87.46 2.42 -9.42 0.14 0
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222296 85296383 1 FNO5C17H18 ABC5D17E18 -252.94 3.94 -9.9 -0.84 0
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222297 85296394 1 NO3C20H27 AB3C20D27 -127.87 2.03 -9.38 0.0 0
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222298 85296417 1 O8C15H24 A8B15C24 -377.18 1.42 -10.25 -0.03 0
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222299 85296424 1 BrO6C12H13 AB6C12D13 -173.41 1.6 -10.37 -1.17 0
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222300 85296425 1 CrNO6C13H15 ABC6D13E15 -220.69 3.97 -7.84 0.3 0
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222301 85296433 1 NO4C19H27 AB4C19D27 -143.7 2.44 -8.21 0.31 0
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222302 85296505 1 ClNOPH15C19 ABCDE15F19 7.89 2.9 -9.63 -0.79 1
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222304 85296524 1 SiO2C21H28 AB2C21D28 -90.87 0.49 -9.36 0.19 0
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222305 85296527 1 NO5C19H19 AB5C19D19 -164.71 4.09 -9.0 -0.29 1
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222307 85296543 1 SO4H18C19 AB4C18D19 -60.8 1.78 -8.67 -1.24 0
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222308 85296596 1 N3O5C17H21 A3B5C17D21 -169.15 5.3 -8.72 -0.61 0
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222309 85296645 1 SiO2C22H26 AB2C22D26 -42.54 6.29 -9.55 -0.57 0
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222310 85296646 1 SiO2C21H38 AB2C21D38 -125.48 0.52 -9.6 1.09 0
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222311 85296649 1 NO6C18H25 AB6C18D25 -222.84 1.93 -9.54 -0.1 0
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222312 85296653 1 O2N3C21H25 A2B3C21D25 -43.85 5.31 -9.09 -0.06 0
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222313 85296656 1 NO2C23H29 AB2C23D29 -43.34 2.79 -9.0 0.4 0
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222314 85296661 1 BrNO4H14C15 ABC4D14E15 -67.81 8.23 -9.2 -1.39 0
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222315 85296662 1 IO2C14H25 AB2C14D25 -107.16 2.85 -9.35 -0.62 0
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222316 85296663 1 IOSiC13H25 ABCD13E25 -85.65 1.28 -8.86 -0.93 0
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222317 85296672 1 SiO4C19H32 AB4C19D32 -202.35 1.38 -9.2 0.18 0
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222318 85296673 1 SiO3C20H36 AB3C20D36 -207.23 2.67 -8.67 -0.52 0
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222319 85296680 1 NO5H19C20 AB5C19D20 -104.57 7.7 -8.36 -1.15 0
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222320 85296681 1 O2N3C22H33 A2B3C22D33 -94.46 7.36 -8.74 0.5 0
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222321 85296684 1 NOH23C25 ABC23D25 53.47 2.56 -8.75 -0.27 0
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222322 85296688 1 IOC15H27 ABC15D27 -76.43 3.27 -9.41 -0.72 0
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222324 85296738 1 O3H22C24 A3B22C24 -46.46 2.8 -9.48 -0.55 0
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222325 85296756 1 NO2C23H37 AB2C23D37 -121.73 4.07 -9.13 0.77 0
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222326 85296812 1 O2N3C22H27 A2B3C22D27 -74.53 3.07 -8.54 -0.17 0
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222328 85296814 3 O2H6C7 A2B6C7 -171.19 2.39 -8.26 -1.34 0
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222329 85296861 1 SiO5C19H34 AB5C19D34 -292.41 3.57 -8.91 -0.04 0
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222330 85296894 1 NSiO3C21H31 ABC3D21E31 -101.53 1.96 -8.97 0.23 0
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222331 85296941 1 N2O5H18C21 A2B5C18D21 -82.47 4.55 -8.11 -0.73 0
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222332 85296972 1 NO5C22H23 AB5C22D23 -126.02 3.93 -8.76 -0.08 0
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222333 85296974 1 NO6C20H31 AB6C20D31 -259.14 4.42 -9.92 0.7 0
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222334 85296977 1 NO4C22H39 AB4C22D39 -236.99 2.89 -10.18 -0.6 0
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222335 85296997 1 NSeO4C17H23 ABC4D17E23 -147.09 3.03 -8.74 -0.63 0
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222336 85297003 1 N2O2H24C25 A2B2C24D25 4.24 1.78 -9.5 -0.09 0
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222337 85297004 1 SiO7C18H28 AB7C18D28 -261.44 2.23 -8.04 -0.82 0
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222338 85297007 1 O3C25H36 A3B25C36 -130.17 3.03 -8.76 0.09 0
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222339 85297008 1 S2O4C19H28 A2B4C19D28 -176.81 3.93 -8.36 0.34 0
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222340 85297046 1 SO8C17H24 AB8C17D24 -324.65 3.36 -9.09 0.13 0
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222341 85297048 1 O8C19H32 A8B19C32 -370.72 5.79 -9.8 0.72 0
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222342 85297074 1 SeO2C21H28 AB2C21D28 -80.51 2.77 -8.54 -0.32 0
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222343 85297075 1 N3O4H21C22 A3B4C21D22 -4.84 4.67 -9.18 -1.1 0
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222344 85297078 1 BrSiO2C18H35 ABC2D18E35 -149.17 0.93 -8.96 0.04 0
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222345 85297082 1 NSiO2C23H41 ABC2D23E41 -127.05 4.6 -8.28 0.68 0
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222346 85297102 1 NCl2O4H17C19 AB2C4D17E19 -51.87 6.68 -9.93 -1.45 0
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222347 85297137 1 BrO5C18H21 AB5C18D21 -185.31 1.7 -8.89 -0.21 0
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222348 85297138 1 NSF4O6H11C14 ABC4D6E11F14 -302.91 4.71 -10.63 -1.59 0