List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
140313 52681553 1 N4O5C23H27 A4B5C23D27 -114.46 4.14 0.0 0.0 1
140314 52681554 1 N4O5C23H27 A4B5C23D27 -110.99 2.44 0.0 0.0 0
140315 52681555 1 ClSO3N4C20H21 ABC3D4E20F21 -48.68 7.19 -9.08 -1.26 1
140316 52681572 1 O2S2N5C22H24 A2B2C5D22E24 8.88 3.38 0.0 0.0 0
140317 52681750 1 OSN6C25H32 ABC6D25E32 40.85 2.88 -8.56 -0.2 0
140318 52681893 1 BrN3O3C23H28 AB3C3D23E28 -88.29 6.52 -8.87 -0.82 0
140319 52682002 1 SO2N4C21H32 AB2C4D21E32 -62.08 3.8 -8.6 0.09 0
140320 52682003 1 SO2N4C21H32 AB2C4D21E32 -69.64 5.76 -8.75 0.01 0
140321 52682004 2 OSN3C10H14 ABC3D10E14 5.95 6.2 -8.61 -0.41 0
140322 52682005 1 S2F3O3N4C18H23 A2B3C3D4E18F23 -224.97 9.9 -8.81 -1.43 0
140323 52682006 1 SO2N5C24H31 AB2C5D24E31 -30.93 4.15 -8.67 -0.85 0
140324 52682007 1 S2O3N5C22H33 A2B3C5D22E33 -69.19 8.49 -8.82 -0.65 0
140325 52682238 1 FO4N5C21H24 AB4C5D21E24 -93.82 4.58 -9.19 -1.27 0
140326 52682562 1 F3O3N6C21H25 A3B3C6D21E25 -184.45 1.6 -9.26 -1.19 0
140327 52682920 1 FON2C20H23 ABC2D20E23 -50.09 5.73 -8.34 0.05 0
140328 52682921 1 FON2C20H23 ABC2D20E23 -52.77 2.69 -8.48 -0.17 0
140329 52683121 1 O3H20C22 A3B20C22 -35.19 3.64 -9.09 -0.99 0
140330 52683122 1 O2N3H19C21 A2B3C19D21 24.5 2.67 -8.97 -1.15 0
140331 52683259 1 O2N5C20H21 A2B5C20D21 19.85 0.98 -8.99 -0.94 1
140332 52683342 1 SN3O3C23H30 AB3C3D23E30 -49.4 5.56 0.0 0.0 0
140333 52683421 1 SCl2O2N4C19H24 AB2C2D4E19F24 -51.18 3.72 -9.23 -0.67 1
140334 52683502 1 OCl2N3C20H24 AB2C3D20E24 0.07 11.32 0.0 0.0 1
140335 52683926 1 F2N2O2C19H21 A2B2C2D19E21 -116.83 2.36 0.0 0.0 -1
140336 52683937 1 SO2N5H20C23 AB2C5D20E23 98.52 1.48 0.0 0.0 0
140337 52684387 1 ClN2O2C21H25 AB2C2D21E25 -61.55 3.24 -8.67 -0.14 1
140338 52684686 1 N3O4C23H30 A3B4C23D30 -43.86 7.07 0.0 0.0 1
140339 52684699 1 N4O4C23H31 A4B4C23D31 -17.71 7.23 0.0 0.0 1
140340 52684899 1 ON3C23H36 AB3C23D36 -15.79 2.78 0.0 0.0 1
140341 52685329 1 N2O2C24H33 A2B2C24D33 -55.46 7.8 0.0 0.0 0
140342 52685330 2 NOC12H16 ABC12D16 -74.74 6.43 -8.77 -0.18 0
140343 52685378 2 ON2C13H17 AB2C13D17 -65.79 8.42 -8.59 -0.92 1
140344 52685461 1 N4O5C26H33 A4B5C26D33 -84.55 10.77 0.0 0.0 0
140345 52685462 1 N4O5C26H32 A4B5C26D32 -104.46 8.93 -8.95 -1.55 0
140346 52685677 1 SN2O5C25H28 AB2C5D25E28 -141.76 5.99 -8.96 -0.37 0
140347 52685688 1 SN3O5C23H25 AB3C5D23E25 -139.41 4.48 -9.03 -0.86 0
140348 52685723 1 SN3O3H23C26 AB3C3D23E26 -18.78 3.25 -9.05 -1.5 0
140349 52685730 1 N2O3C25H26 A2B3C25D26 -69.89 3.39 -9.02 -0.1 1
140350 52685934 1 N2O2C17H27 A2B2C17D27 -38.99 4.23 0.0 0.0 0
140351 52685935 1 N2O2C17H26 A2B2C17D26 -59.91 4.42 -8.51 0.5 1
140352 52685936 1 O2N3C23H32 A2B3C23D32 -29.57 5.37 0.0 0.0 0
140353 52686435 1 FON4C16H21 ABC4D16E21 -46.21 2.33 -8.58 -0.03 0
140354 52686436 1 SN2O5C12H18 AB2C5D12E18 -213.63 7.36 -10.82 -1.49 0
140355 52686437 1 SN2O5C14H16 AB2C5D14E16 -175.88 7.4 -9.7 -1.02 0
140356 52686438 1 SN2O5C14H16 AB2C5D14E16 -176.09 3.66 -9.62 -1.04 0
140357 52686439 1 N2O3C21H38 A2B3C21D38 -210.86 3.59 -9.39 0.79 0
140358 52686511 1 BrFO2N3C21H21 ABC2D3E21F21 -70.69 4.01 -8.62 -0.95 0
140359 52686516 1 O3N5C27H33 A3B5C27D33 -80.67 5.38 -8.46 -0.15 0
140360 52686563 1 S2O3N4C20H28 A2B3C4D20E28 -100.08 5.23 -8.98 -0.46 0
140361 52686704 1 N3S3O4C16H19 A3B3C4D16E19 -55.96 10.11 -8.71 -1.15 0
140362 52686882 1 FOSN4C20H21 ABCD4E20F21 2.76 6.06 -9.36 -0.63 0
140363 52686930 1 OSN4C21H24 ABC4D21E24 41.84 3.42 -8.68 -0.77 1
140364 52687205 1 SN3O4C24H34 AB3C4D24E34 -111.9 3.99 0.0 0.0 0
140365 52687380 1 O2S2N5C21H25 A2B2C5D21E25 -12.86 8.94 -8.22 -0.89 1
140366 52687446 1 O2N3C23H30 A2B3C23D30 -34.37 3.18 0.0 0.0 0
140367 52687447 1 O2N3C23H29 A2B3C23D29 -54.12 6.57 -8.66 -0.08 -1
140368 52687496 1 NCl2S2O4H12C13 AB2C2D4E12F13 -88.66 5.71 0.0 0.0 0
140369 52687497 1 NCl2S2O4C13H13 AB2C2D4E13F13 -113.93 4.83 -8.89 -1.23 0
140370 52687665 1 ClSO3N4C10H17 ABC3D4E10F17 -109.18 3.29 -9.13 -0.83 0
140371 52687687 1 OF2N3H17C22 AB2C3D17E22 -41.13 4.41 -8.93 -0.85 0
140372 52687692 1 ClFO2N4H16C19 ABC2D4E16F19 -56.1 7.12 -8.97 -0.92 0
140373 52687693 1 FO3N5H18C22 AB3C5D18E22 -0.89 6.85 -8.92 -1.09 0
140374 52687699 1 FOSN4H17C21 ABCD4E17F21 14.1 6.22 -8.63 -0.78 0
140375 52687864 1 ClO3N4C22H33 AB3C4D22E33 -137.92 2.57 -8.96 -0.59 0
140376 52687865 1 N2O3C31H36 A2B3C31D36 -83.14 4.49 -8.89 -0.07 0
140377 52687866 1 N2O3C31H36 A2B3C31D36 -82.93 4.59 -8.82 0.03 0
140378 52687867 1 BrFNO3H15C17 ABCD3E15F17 -129.03 4.79 -9.66 -0.69 0
140379 52688138 1 O3N4H22C26 A3B4C22D26 -35.29 6.61 -8.71 -0.6 0
140380 52688430 1 FON3H16C19 ABC3D16E19 4.94 9.87 -8.89 -1.2 0
140381 52688675 1 N3O6H23C24 A3B6C23D24 -126.34 7.24 -8.54 -0.61 0
140382 52688823 1 ClNO5H18C21 ABC5D18E21 -132.7 8.56 -8.8 -1.18 0
140383 52688871 1 IN2O4C18H19 AB2C4D18E19 -94.41 9.64 -8.59 -0.73 0
140384 52689336 3 NOSC6H9 ABCD6E9 -102.48 12.33 -8.54 -0.95 0
140385 52689337 3 NOSC6H9 ABCD6E9 -103.53 11.62 -8.66 -1.1 -1
140386 52689573 1 ClSN3O4C21H21 ABC3D4E21F21 -52.43 6.31 0.0 0.0 -1
140387 52689695 1 ClSF2N3O5H13C18 ABC2D3E5F13G18 -174.46 2.99 0.0 0.0 0
140388 52690034 1 ClON3C22H34 ABC3D22E34 -56.75 5.49 -8.63 -0.06 1
140389 52690035 1 N3O3C25H40 A3B3C25D40 -100.81 1.75 0.0 0.0 0
140390 52690036 1 N3O3C25H39 A3B3C25D39 -116.9 5.7 -8.25 0.15 1
140391 52690037 1 ON5C20H36 AB5C20D36 -17.07 4.72 0.0 0.0 0
140392 52690113 1 SO2N3C20H27 AB2C3D20E27 -64.97 3.75 -9.27 -0.4 0
140393 52690162 1 SF2N3O4C20H29 AB2C3D4E20F29 -263.86 6.55 -9.43 -0.98 0
140394 52690163 1 S2O3N4C20H28 A2B3C4D20E28 -118.08 3.7 -8.79 -1.27 0
140395 52690428 1 SF2N3O4C19H21 AB2C3D4E19F21 -197.55 4.78 -8.95 -1.26 0
140396 52690491 1 O2N5H23C26 A2B5C23D26 17.29 5.1 -7.92 -1.13 0
140397 52691746 1 SN4O4C22H30 AB4C4D22E30 -101.43 5.51 -8.67 -0.84 1
140398 52691859 1 FNOC19H23 ABCD19E23 -57.74 5.51 0.0 0.0 0
140399 52692068 1 N3O5C25H39 A3B5C25D39 -232.22 2.42 -9.13 -0.22 0
140400 52692187 1 SN2O3H24C25 AB2C3D24E25 -38.54 7.16 -8.42 -0.9 0
140401 52692188 1 N2F3O3H25C26 A2B3C3D25E26 -230.18 4.27 -8.7 -0.98 0
140402 52692274 1 N3O3H17C21 A3B3C17D21 -25.67 2.06 -8.62 -1.15 0
140403 52692275 1 SN2O5C25H28 AB2C5D25E28 -150.15 8.49 -8.32 -0.9 0
140404 52692328 1 SN3O4C24H31 AB3C4D24E31 -115.45 5.9 -9.4 -1.34 0
140405 52692329 1 SN3O4C24H31 AB3C4D24E31 -115.13 6.63 -9.37 -1.36 1
140406 52692620 1 O2N4C23H27 A2B4C23D27 4.44 5.24 0.0 0.0 0
140407 52692622 1 FOSN2H15C20 ABCD2E15F20 21.0 5.41 -9.43 -1.24 -1
140408 52692649 1 FSO3N4C23H26 ABC3D4E23F26 -73.41 3.29 0.0 0.0 0
140409 52692650 1 FSO3N4C23H27 ABC3D4E23F27 -109.25 7.11 -8.94 -0.23 0
140410 52692651 1 FON3C20H28 ABC3D20E28 -69.18 4.93 -8.95 -0.23 0
140411 52693179 1 SO3N4C26H32 AB3C4D26E32 -66.97 7.95 -8.66 -0.8 1
140412 52693798 1 O3N4C24H39 A3B4C24D39 -104.23 3.46 0.0 0.0 0