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This page enables the filtering of files for their MIME type. Input: contenttype/subtype or contenttype/*, e.g. image/jpeg.

Showing below up to 50 results in range #851 to #900.

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  1. (download) 20140226 Endo cyclohexene dimer Avogadro MMFF94s.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 20:02, 26 February 2014
  2. (download) 20140226 Exo cyclohexene dimer 55,3774 kcal per mol MMFF94.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 19:36, 26 February 2014
  3. (download) 20140226 Exo cyclohexene dimer Avogadro MMFF94s.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 20:40, 26 February 2014
  4. (download) 20140226 Flat Chemdraw cyclohexene dimer.mol . . 0 × 0 . . 1 KB . . Jm4311 . . 19:27, 26 February 2014
  5. (download) 20140226 Hydrogenated 3B dimer Avogadro MMFF94s HIGHER ENERGY.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 21:48, 26 February 2014
  6. (download) 20140226 Hydrogenated 3 dimer Avogadro MMFF94s.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 21:38, 26 February 2014
  7. (download) 20140226 Labelled O-down 18 nmr opt freq gd3 benz (once) B3LYP 6-31Gdp.mol . . 0 × 0 . . 5 KB . . Jm4311 . . 11:31, 26 February 2014
  8. (download) 20140226 Labelled O-up 17 nmr opt freq gd3 chloro (once) B3LYP 6-31Gdp.mol . . 0 × 0 . . 5 KB . . Jm4311 . . 10:01, 26 February 2014
  9. (download) 20140227 Dimerisation ENDO Berny TS noeigen opt freq once HF 3-21G.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 16:15, 27 February 2014
  10. (download) 20140227 Dimerisation ENDO Berny TS noeigen opt freq once HF 3-21G mo36 HOMO.cub.xyz . . 0 × 0 . . 796 bytes . . Jm4311 . . 16:56, 27 February 2014
  11. (download) 20140227 Dimerisation EXO Berny TS noeigen opt freq once HF 3-21G.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 15:50, 27 February 2014
  12. (download) 20140227 Dimerisation EXO Berny TS noeigen opt freq once HF 3-21G mo36 HOMO.cub.xyz . . 0 × 0 . . 796 bytes . . Jm4311 . . 17:01, 27 February 2014
  13. (download) 20140228 Taxol precursor O-down 10 from Avogadro MMFF94s.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 19:49, 28 February 2014
  14. (download) 20140228 Taxol precursor O-down 10 from Avogadro MMFF94s 60,55146.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 19:50, 28 February 2014
  15. (download) 20140228 Taxol precursor O-down 10 from Avogadro MMFF94s 74,75838 unstable chair.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 20:53, 28 February 2014
  16. (download) 20140228 Taxol precursor O-down 10 from Avogadro MMFF94s 81,52509 unstable boat.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 21:16, 28 February 2014
  17. (download) 20140228 Taxol precursor O-up 9 from Avogadro MMFF94s.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 19:24, 28 February 2014
  18. (download) 20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 102,35881 ts.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 13:18, 1 March 2014
  19. (download) 20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 70,53838 stable chair.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 20:23, 28 February 2014
  20. (download) 20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 76,28966 boat form.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 20:18, 28 February 2014
  21. (download) 20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 82,74304.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 20:08, 28 February 2014
  22. (download) 20140228 Taxol precursor O-up 9 from Avogadro MMFF94s 88,16573 unstable boat.mol . . 0 × 0 . . 4 KB . . Jm4311 . . 21:43, 28 February 2014
  23. (download) 20140301 B-MeSty Ox B3LYP 6-31Gdp nmr s-s mixed chloro freq GD3.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 18:43, 1 March 2014
  24. (download) 20140301 H2napth Ox B3LYP 6-31Gpd nmr s-s mixed chloro f 88689.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 17:52, 1 March 2014
  25. (download) 20140301 Stilbene Ox B3LYP 6-31Gdp nmr s-s mixed chlor freq 88688.mol . . 0 × 0 . . 3 KB . . Jm4311 . . 17:36, 1 March 2014
  26. (download) 20140301 Styrene Ox B3LYP 6-31Gdp nmr s-s mixed chloro freq GD3 88690.mol . . 0 × 0 . . 2 KB . . Jm4311 . . 18:27, 1 March 2014
  27. (download) 20140302 O-down S-down B3LYP 6-31Gdp nmr.mol . . 0 × 0 . . 5 KB . . Jm4311 . . 12:20, 3 March 2014
  28. (download) 20140302 O-up S-up B3LYP 6-31Gdp nmr.mol . . 0 × 0 . . 5 KB . . Jm4311 . . 10:39, 3 March 2014
  29. (download) 20140303 O-up S-up alkene fragment.mol . . 0 × 0 . . 1 KB . . Jm4311 . . 11:59, 3 March 2014
  30. (download) 20140304DownDownNonCovalent.xyz . . 0 × 0 . . 2 KB . . Jm4311 . . 13:54, 4 March 2014
  31. (download) 20140304UpUpNonCovalent.cub.xyz . . 0 × 0 . . 2 KB . . Jm4311 . . 14:03, 4 March 2014
  32. (download) 20140304 O-down S-down B3LYP 6-31Gdp nmr 88835 mo95.cub.xyz . . 0 × 0 . . 2 KB . . Jm4311 . . 11:46, 4 March 2014
  33. (download) 20140306SSDistortedStilbene.cub.xyz . . 0 × 0 . . 3 KB . . Jm4311 . . 16:50, 6 March 2014
  34. (download) 20140506RRStilbeneTotalDensity1.cub.xyz . . 0 × 0 . . 3 KB . . Jm4311 . . 16:55, 6 March 2014
  35. (download) 2015 03 05 ELC BH3 freq OPT.mol . . 0 × 0 . . 438 bytes . . El1612 . . 13:42, 5 March 2015
  36. (download) 2015 05 03 ELC GaBr3 Freq output.mol . . 0 × 0 . . 435 bytes . . El1612 . . 13:40, 5 March 2015
  37. (download) 2015 ELC BORATABENZENE OPT 631GDP CHARGE.LOG . . 0 × 0 . . 151 KB . . El1612 . . 16:13, 10 March 2015
  38. (download) 2015 ELC BORATABENZENE OPT 631GDP SYMM.LOG . . 0 × 0 . . 166 KB . . El1612 . . 15:46, 10 March 2015
  39. (download) 2015 ELC NH3BH3 OPT.LOG . . 0 × 0 . . 110 KB . . El1612 . . 12:43, 6 March 2015
  40. (download) 2015 ELC NH3BH3 SYMM FREQ.mol . . 0 × 0 . . 812 bytes . . El1612 . . 13:07, 6 March 2015
  41. (download) 2015 ELC NH3 NBO.mol . . 0 × 0 . . 432 bytes . . El1612 . . 11:55, 6 March 2015
  42. (download) 2015 ELC PYRIDINIUM FREQ 631GDP.mol . . 0 × 0 . . 1 KB . . El1612 . . 09:21, 11 March 2015
  43. (download) 21(2).mol . . 0 × 0 . . 1 KB . . Yh3511 . . 16:29, 13 November 2013
  44. (download) 21.mol . . 0 × 0 . . 7 KB . . Ft311 . . 20:14, 22 November 2013
  45. (download) 2105 ELC NH3 FREQ 631GDP.mol . . 0 × 0 . . 433 bytes . . El1612 . . 11:09, 6 March 2015
  46. (download) 21FFinal boat TS opt DFT.gjf . . 0 × 0 . . 1 KB . . Bw08 . . 11:20, 21 March 2011
  47. (download) 21Mercury AGB.mol . . 0 × 0 . . 4 KB . . Ab6511 . . 13:31, 28 November 2013
  48. (download) 21 Chair DFT.out . . 0 × 0 . . 196 KB . . Bw08 . . 12:02, 21 March 2011
  49. (download) 21 O-C-O bond lengths SL.mol . . 0 × 0 . . 4 KB . . Sl4911 . . 13:28, 13 October 2013
  50. (download) 21 O-C-O bond lengths SL.mol2 . . 0 × 0 . . 4 KB . . Sl4911 . . 13:19, 13 October 2013

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