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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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222349 85297139 1 PO4N5C17H28 AB4C5D17E28 -198.64 5.97 -9.04 -0.49 0
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222350 85297148 1 ClO2N3C22H32 AB2C3D22E32 -63.32 6.2 -8.92 0.13 0
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222351 85297154 1 O4C25H34 A4B25C34 -163.37 1.8 -9.05 0.31 0
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222352 85297194 1 NO5C23H33 AB5C23D33 -238.52 6.2 -8.77 0.21 0
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222353 85297207 1 FON2C26H29 ABC2D26E29 56.63 21.66 -6.92 -1.64 0
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222354 85297211 1 O4N7C19H19 A4B7C19D19 -17.85 9.03 -9.57 -1.57 0
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222355 85297224 1 O4C25H42 A4B25C42 -147.47 5.36 -8.2 0.55 0
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222356 85297226 1 NO3F6H15C18 AB3C6D15E18 -377.89 4.16 -9.81 -1.1 0
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222357 85297229 1 NO4C25H29 AB4C25D29 -142.19 3.38 -8.81 -0.36 0
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222359 85297234 1 ClNO4C22H30 ABC4D22E30 -138.51 14.73 -8.34 -0.44 0
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222360 85297236 1 P2O7C18H18 A2B7C18D18 -313.1 2.98 -9.3 -0.97 0
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222361 85297263 1 FNOH26C28 ABCD26E28 -13.3 4.04 -7.94 -0.68 1
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222363 85297272 1 BrNO4C19H26 ABC4D19E26 -178.77 7.01 -9.93 -0.31 0
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222366 85297275 1 FN2O7C19H25 AB2C7D19E25 -353.39 4.76 -9.07 -0.33 0
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222367 85297279 1 PSO5C20H29 ABC5D20E29 -269.09 6.68 -9.14 -0.92 0
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222368 85297280 1 N2O3H24C26 A2B3C24D26 -15.05 3.74 -9.19 -0.34 0
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222369 85297282 1 SO4C24H28 AB4C24D28 -127.02 1.82 -8.7 -0.27 0
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222370 85297283 1 O6C23H40 A6B23C40 -328.96 2.47 -10.25 -0.34 0
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222371 85297284 1 SSiO4C21H36 ABC4D21E36 -248.83 2.83 -8.5 -0.04 0
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222373 85297288 1 Cl2O3C22H30 A2B3C22D30 -137.73 6.97 -9.81 -0.16 0
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222374 85297289 1 NSO8C18H23 ABC8D18E23 -246.14 4.38 -8.79 -1.75 0
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222376 85297292 1 N2P2C11O11H16 A2B2C11D11E16 -561.42 17.33 -10.68 -2.55 0
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222378 85297300 1 O7C23H26 A7B23C26 -237.22 3.97 -8.46 -0.92 0
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222379 85297303 1 PSiF2O4C18H37 ABC2D4E18F37 -420.27 3.18 -8.64 0.11 0
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222380 85297307 1 SiO3C25H38 AB3C25D38 -152.14 1.37 -8.89 -0.37 0
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222381 85297309 1 Si2O3C22H46 A2B3C22D46 -273.08 4.01 -8.65 0.06 0
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222382 85297312 1 NPO8C18H26 ABC8D18E26 -375.67 3.0 -9.29 0.34 0
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222383 85297322 1 SO5C23H28 AB5C23D28 -143.9 6.47 -8.11 -0.05 0
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222384 85297323 2 SO2C11H12 AB2C11D12 -118.55 1.56 -8.62 -0.89 0
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222385 85297326 1 O3C27H44 A3B27C44 -206.27 6.56 -9.18 0.73 0
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222386 85297328 1 NF3O4C21H30 AB3C4D21E30 -359.93 2.04 -9.55 0.17 0
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222387 85297332 1 IN2O5C14H15 AB2C5D14E15 -129.88 3.64 -9.23 -1.43 0
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222388 85297334 1 O5C26H26 A5B26C26 -129.39 5.47 -8.68 -0.46 0
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222389 85297340 1 NO7H17C23 AB7C17D23 -212.56 3.2 -9.76 -1.66 0
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222390 85297343 1 OF3N3C22H40 AB3C3D22E40 -234.68 3.63 -8.56 -0.12 2
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222392 85297345 1 SF3O4H15C21 AB3C4D15E21 -225.16 6.0 -9.73 -1.03 0
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222393 85297346 1 PSF2O5C18H23 ABC2D5E18F23 -331.01 3.45 -9.91 -0.5 0
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222394 85297347 1 N4O7C19H24 A4B7C19D24 -39.56 4.85 -9.4 -1.87 0
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222395 85297352 1 N2O3C26H32 A2B3C26D32 -104.39 1.01 -9.3 -0.22 0
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222396 85297361 1 BrClO4H14C19 ABC4D14E19 -75.41 7.29 -8.91 -1.56 0
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222397 85297362 1 NSSiO2C23H39 ABCD2E23F39 -117.91 4.89 -8.53 -0.28 0
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222399 85297376 1 SO2N3C24H29 AB2C3D24E29 10.97 1.98 -8.35 -0.54 0
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222400 85297377 1 NO3C27H37 AB3C27D37 -119.45 5.87 -9.34 0.04 0
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222401 85297378 1 NSSiO6C18H37 ABCD6E18F37 -324.76 1.68 -9.54 0.44 0
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222402 85297381 1 O3N6C22H28 A3B6C22D28 -45.4 3.29 -9.07 -0.73 0
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222403 85297383 1 N2O4C25H32 A2B4C25D32 -76.44 5.26 -8.99 -0.25 0
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222405 85300606 1 NO5C17H21 AB5C17D21 -153.58 3.7 -9.4 -0.14 0
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222406 85300611 1 NSO3C17H21 ABC3D17E21 -72.08 4.37 -9.57 -0.09 0
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222407 85300613 1 O2N3C18H29 A2B3C18D29 -103.24 5.01 -8.66 1.29 0
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222408 85300614 1 NSO2C18H25 ABC2D18E25 -83.78 8.42 -8.54 0.09 0