List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
98300 50042506 1 FN6O6C41H43 AB6C6D41E43 -211.24 7.28 -8.63 -0.45 0
98301 50042514 1 F2O5N6C35H40 A2B5C6D35E40 -268.07 9.55 -8.53 -0.56 0
98302 50042516 1 F3O5N6C41H43 A3B5C6D41E43 -284.42 15.19 -8.82 -0.57 0
98303 50042519 1 F2O5N6C40H48 A2B5C6D40E48 -277.36 10.93 -9.06 -0.5 0
98304 50042521 1 F2O5N6C34H38 A2B5C6D34E38 -248.56 4.76 -9.13 -0.68 0
98305 50042524 1 F4O5N6H38C39 A4B5C6D38E39 -315.27 11.67 -9.18 -0.9 0
98306 50042529 1 F2O5N6C39H40 A2B5C6D39E40 -226.87 10.08 -8.78 -0.59 0
98307 50042531 1 ClF2O5N6C37H41 AB2C5D6E37F41 -262.35 7.96 -8.97 -1.1 0
98308 50042533 1 ClF2O5N6C39H45 AB2C5D6E39F45 -278.95 3.97 -9.07 -0.55 0
98309 50042535 1 ClF2O5N6C38H43 AB2C5D6E38F43 -277.54 4.0 -8.97 -0.75 0
98310 50042536 1 ClF2O5N6C39H45 AB2C5D6E39F45 -280.11 7.55 -9.18 -0.73 0
98311 50042537 1 ClF2O5N6C37H43 AB2C5D6E37F43 -282.58 12.24 -8.89 -0.87 0
98312 50042540 1 ClF2O5N6C39H39 AB2C5D6E39F39 -232.45 13.98 -8.86 -1.02 0
98313 50042548 1 ClFO4N5C34H39 ABC4D5E34F39 -187.16 10.05 -8.75 -0.77 0
98314 50042561 1 F2O4N5C38H39 A2B4C5D38E39 -199.2 12.55 -8.52 -0.53 0
98315 50042562 1 FO4N5C37H44 AB4C5D37E44 -194.52 6.03 -8.33 -0.38 0
98316 50042563 1 FN5O5C37H38 AB5C5D37E38 -179.52 9.8 -8.59 -0.52 0
98317 50042575 1 BrF2O5N6C35H39 AB2C5D6E35F39 -264.76 10.15 -9.0 -0.69 0
98318 50042585 1 ClF2O5N6C38H43 AB2C5D6E38F43 -280.48 10.28 -8.96 -0.67 0
98319 50042654 1 F2O5N6C41H42 A2B5C6D41E42 -227.96 9.22 -8.57 -0.98 0
98320 50042660 1 FO5N6C40H41 AB5C6D40E41 -177.46 7.35 -8.63 -0.58 0
98321 50042661 1 F2O5N6C40H40 A2B5C6D40E40 -220.73 8.14 -8.68 -0.82 0
98322 50042670 1 F3O5N6C40H41 A3B5C6D40E41 -273.94 12.31 -9.08 -0.64 0
98323 50042671 1 F3O5N6C40H41 A3B5C6D40E41 -281.59 3.27 -8.67 -0.54 0
98324 50042672 1 F3O5N6C39H39 A3B5C6D39E39 -269.98 11.56 -8.48 -0.56 0
98325 50042673 1 F4O5N6H38C39 A4B5C6D38E39 -315.16 3.85 -9.08 -0.83 0
98326 50042678 1 F3O5N6C35H39 A3B5C6D35E39 -312.99 9.87 -8.91 -0.43 0
98327 50042704 1 ClFO4N5C31H33 ABC4D5E31F33 -175.59 10.9 -8.81 -0.59 0
98328 50042730 1 ClF2O5N6C38H43 AB2C5D6E38F43 -281.24 9.61 -8.86 -1.07 0
98329 50042748 1 F2O5N6C38H44 A2B5C6D38E44 -273.06 13.11 -8.9 -0.56 0
98330 50042749 1 F2O5N6C39H46 A2B5C6D39E46 -275.93 11.17 -8.88 -0.54 0
98331 50042767 1 F2N6O6C33H36 A2B6C6D33E36 -292.87 10.25 -8.21 -0.45 0
98332 50042770 1 F3N6O6H37C38 A3B6C6D37E38 -300.48 11.16 -8.74 -0.59 0
98333 50042771 1 F2N6O6C39H40 A2B6C6D39E40 -263.5 5.6 -8.37 -0.58 0
98334 50042781 1 F2O5N6C35H40 A2B5C6D35E40 -266.35 6.94 -8.92 -0.61 0
98335 50042811 1 F2O5N6C41H42 A2B5C6D41E42 -230.54 9.19 -8.7 -0.57 0
98336 50042854 2 FN3O3C19H23 AB3C3D19E23 -307.4 9.5 -8.9 -0.47 0
98337 50042894 1 ClF2O5N6C38H43 AB2C5D6E38F43 -281.54 10.82 -8.93 -0.93 0
98338 50042898 1 ClF2O5N6C33H35 AB2C5D6E33F35 -271.98 7.97 -8.54 -0.61 0
98339 50042900 1 ClF2O5N6C38H43 AB2C5D6E38F43 -282.71 6.95 -8.58 -0.54 0
98340 50042914 1 F3O5N6C39H39 A3B5C6D39E39 -271.66 9.6 -8.83 -0.78 0
98341 50042929 2 FN3O3C19H22 AB3C3D19E22 -305.4 4.52 -8.26 -0.63 0
98342 50042943 1 F3O5N6C39H39 A3B5C6D39E39 -284.75 10.05 -8.88 -0.65 0
98343 50042944 1 ClF2O5N6C32H33 AB2C5D6E32F33 -264.4 7.58 -9.0 -0.78 0
98344 50042965 1 BrO5N6C37H43 AB5C6D37E43 -176.82 9.63 -8.61 -0.62 0
98345 50042967 1 BrO5N6C35H39 AB5C6D35E39 -158.12 4.27 -8.9 -0.65 0
98346 50042980 1 ClO5N6C40H41 AB5C6D40E41 -137.59 3.72 -8.66 -0.64 0
98347 50042982 1 ClO5N6C36H41 AB5C6D36E41 -175.49 5.38 -8.88 -0.48 0
98348 50042987 1 F4O5N6H38C39 A4B5C6D38E39 -315.38 13.23 -8.79 -0.68 0
98349 50042995 1 F3O5N6C39H45 A3B5C6D39E45 -319.66 5.4 -9.2 -0.61 0
98350 50043015 1 F2O5N6C38H44 A2B5C6D38E44 -267.39 3.83 -9.1 -0.58 0
98351 50043022 1 FO4N5C36H42 AB4C5D36E42 -178.49 11.41 -8.71 -0.53 0
98352 50043026 1 FO4N5C35H40 AB4C5D35E40 -179.87 14.8 -8.52 -0.54 0
98353 50043036 1 FN5O5C37H44 AB5C5D37E44 -223.42 5.63 -8.28 -0.39 0
98354 50043051 1 ClF2O5N6C37H41 AB2C5D6E37F41 -281.31 8.59 -9.02 -0.97 0
98355 50043052 1 ClF2O5N6C38H43 AB2C5D6E38F43 -287.11 10.96 -8.85 -0.99 0
98356 50043054 1 ClF2O5N6C33H35 AB2C5D6E33F35 -261.36 8.91 -8.88 -1.04 0
98357 50043069 1 F2O5N6C39H46 A2B5C6D39E46 -277.98 7.9 -9.08 -0.96 0
98358 50043070 1 F2O5N6C36H42 A2B5C6D36E42 -276.55 9.49 -8.92 -0.63 0
98359 50043080 1 BrF2O3N4C29H29 AB2C3D4E29F29 -162.45 4.68 -8.79 -0.76 0
98360 50043086 1 F2O5N6C38H38 A2B5C6D38E38 -223.43 9.96 -8.55 -0.56 0
98361 50043087 1 F3O5N6H37C38 A3B5C6D37E38 -274.06 9.51 -8.68 -0.64 0
98362 50043090 1 F2N6O6C39H40 A2B6C6D39E40 -266.9 9.77 -8.72 -0.57 0
98363 50043124 1 N6O6C39H46 A6B6C39D46 -200.73 12.55 -8.55 -0.4 0
98364 50043125 1 ClO5N6C40H47 AB5C6D40E47 -188.11 13.63 -8.5 -0.57 0
98365 50043136 1 ClO5N6C41H43 AB5C6D41E43 -151.23 6.94 -8.38 -0.37 0
98366 50043162 1 F2O5N6C34H38 A2B5C6D34E38 -259.63 12.68 -9.08 -0.89 0
98368 50043180 1 FO4N5C36H42 AB4C5D36E42 -186.1 12.68 -8.56 -0.43 0
98369 50043189 1 F2O4N5H35C36 A2B4C5D35E36 -187.1 8.88 -8.73 -0.97 0
98370 50043218 1 F2N5O5C33H37 A2B5C5D33E37 -256.99 5.31 -8.28 -0.79 0
98371 50043232 1 F3O5N6C40H41 A3B5C6D40E41 -283.21 11.68 -8.93 -0.52 0
98372 50043251 1 F3O5N6H37C38 A3B5C6D37E38 -273.69 6.36 -8.78 -0.69 0
98373 50043274 1 O4N5C34H39 A4B5C34D39 -124.21 3.4 -8.49 -0.25 0
98374 50043279 1 O5N6C39H48 A5B6C39D48 -190.83 11.36 -8.45 -0.56 0
98375 50043295 1 ClO5N6C39H45 AB5C6D39E45 -178.92 10.86 -8.74 -0.88 0