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Port details on branch 2022Q2
avogadro Advanced molecular editor and viewer
1.2.0_2 science Deleted on this many watch lists=1 search for ports that depend on this port Find issues related to this port Report an issue related to this port View this port on Repology. pkg-fallout 1.2.0_2Version of this port present on the latest quarterly branch.
Deprecated DEPRECATED: Qt4 has been EOL since december 2015
Expired This port expired on: 2019-03-15
Maintainer: kde@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2009-05-22 22:17:07
Last Update: 2019-03-16 21:55:51
SVN Revision: 495967
People watching this port, also watch:: p5-type1inst, font-misc-meltho
License: GPLv2+
WWW:
http://avogadro.cc/
Description:
Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible rendering and a powerful plugin architecture. WWW: http://avogadro.cc/
Homepage    cgit ¦ GitHub ¦ GitHub ¦ GitLab ¦ SVNWeb

Manual pages:
pkg-plist: as obtained via: make generate-plist
Expand this list (1171 items)
Collapse this list.
  1. @desktop-file-utils
  2. /usr/local/share/licenses/avogadro-1.2.0_2/catalog.mk
  3. /usr/local/share/licenses/avogadro-1.2.0_2/LICENSE
  4. /usr/local/share/licenses/avogadro-1.2.0_2/GPLv2+
  5. bin/avogadro
  6. bin/avopkg
  7. bin/qube
  8. include/avogadro/animation.h
  9. include/avogadro/atom.h
  10. include/avogadro/bond.h
  11. include/avogadro/camera.h
  12. include/avogadro/color.h
  13. include/avogadro/color3f.h
  14. include/avogadro/colorbutton.h
  15. include/avogadro/config.h
  16. include/avogadro/cube.h
  17. include/avogadro/dockextension.h
  18. include/avogadro/dockwidget.h
  19. include/avogadro/elementtranslator.h
  20. include/avogadro/engine.h
  21. include/avogadro/extension.h
  22. include/avogadro/fragment.h
  23. include/avogadro/glhit.h
  24. include/avogadro/global.h
  25. include/avogadro/glwidget.h
  26. include/avogadro/idlist.h
  27. include/avogadro/mesh.h
  28. include/avogadro/meshgenerator.h
  29. include/avogadro/molecule.h
  30. include/avogadro/moleculefile.h
  31. include/avogadro/navigate.h
  32. include/avogadro/neighborlist.h
  33. include/avogadro/obeigenconv.h
  34. include/avogadro/painter.h
  35. include/avogadro/painterdevice.h
  36. include/avogadro/periodictableview.h
  37. include/avogadro/plotaxis.h
  38. include/avogadro/plotobject.h
  39. include/avogadro/plotpoint.h
  40. include/avogadro/plotwidget.h
  41. include/avogadro/plugin.h
  42. include/avogadro/pluginmanager.h
  43. include/avogadro/primitive.h
  44. include/avogadro/primitivelist.h
  45. include/avogadro/protein.h
  46. include/avogadro/pythonerror.h
  47. include/avogadro/pythoninterpreter.h
  48. include/avogadro/pythonscript.h
  49. include/avogadro/residue.h
  50. include/avogadro/textmatrixeditor.h
  51. include/avogadro/tool.h
  52. include/avogadro/toolgroup.h
  53. include/avogadro/undosequence.h
  54. include/avogadro/zmatrix.h
  55. include/libmsym/msym.h
  56. include/libmsym/msym_error.h
  57. lib/avogadro/1_2/AvogadroUse.cmake
  58. lib/avogadro/1_2/cmake/FindEigen2.cmake
  59. lib/avogadro/1_2/cmake/FindEigen3.cmake
  60. lib/avogadro/1_2/cmake/FindGLEW.cmake
  61. lib/avogadro/1_2/colors/atomindexcolor.so
  62. lib/avogadro/1_2/colors/chargecolor.so
  63. lib/avogadro/1_2/colors/customcolor.so
  64. lib/avogadro/1_2/colors/distancecolor.so
  65. lib/avogadro/1_2/colors/residuecolor.so
  66. lib/avogadro/1_2/colors/smartscolor.so
  67. lib/avogadro/1_2/engines/axesengine.so
  68. lib/avogadro/1_2/engines/cartoonengine.so
  69. lib/avogadro/1_2/engines/dipoleengine.so
  70. lib/avogadro/1_2/engines/forceengine.so
  71. lib/avogadro/1_2/engines/hbondengine.so
  72. lib/avogadro/1_2/engines/labelengine.so
  73. lib/avogadro/1_2/engines/polygonengine.so
  74. lib/avogadro/1_2/engines/qtaimengine.so
  75. lib/avogadro/1_2/engines/ribbonengine.so
  76. lib/avogadro/1_2/engines/ringengine.so
  77. lib/avogadro/1_2/engines/simplewireengine.so
  78. lib/avogadro/1_2/engines/sphereengine.so
  79. lib/avogadro/1_2/engines/stickengine.so
  80. lib/avogadro/1_2/engines/surfaceengine.so
  81. lib/avogadro/1_2/engines/wireengine.so
  82. lib/avogadro/1_2/extensions/animationextension.so
  83. lib/avogadro/1_2/extensions/cartesianextension.so
  84. lib/avogadro/1_2/extensions/crystallographyextension.so
  85. lib/avogadro/1_2/extensions/fileimportextension.so
  86. lib/avogadro/1_2/extensions/forcefieldextension.so
  87. lib/avogadro/1_2/extensions/gamessextension.so
  88. lib/avogadro/1_2/extensions/gl2psextension.so
  89. lib/avogadro/1_2/extensions/h2methylextension.so
  90. lib/avogadro/1_2/extensions/hydrogensextension.so
  91. lib/avogadro/1_2/extensions/inputfileextension.so
  92. lib/avogadro/1_2/extensions/insertdnaextension.so
  93. lib/avogadro/1_2/extensions/insertfragmentextension.so
  94. lib/avogadro/1_2/extensions/insertpeptideextension.so
  95. lib/avogadro/1_2/extensions/invertchiralextension.so
  96. lib/avogadro/1_2/extensions/molecularpropextension.so
  97. lib/avogadro/1_2/extensions/networkfetchextension.so
  98. lib/avogadro/1_2/extensions/orbitalextension.so
  99. lib/avogadro/1_2/extensions/orcaextension.so
  100. lib/avogadro/1_2/extensions/povrayextension.so
  101. lib/avogadro/1_2/extensions/propextension.so
  102. lib/avogadro/1_2/extensions/pythonterminal.so
  103. lib/avogadro/1_2/extensions/qtaimextension.so
  104. lib/avogadro/1_2/extensions/selectextension.so
  105. lib/avogadro/1_2/extensions/spectraextension.so
  106. lib/avogadro/1_2/extensions/supercellextension.so
  107. lib/avogadro/1_2/extensions/surfaceextension.so
  108. lib/avogadro/1_2/extensions/swcntbuilderextension.so
  109. lib/avogadro/1_2/extensions/symmetryextension.so
  110. lib/avogadro/1_2/extensions/vibrationextension.so
  111. lib/avogadro/1_2/extensions/vrmlextension.so
  112. lib/avogadro/1_2/tools/aligntool.so
  113. lib/avogadro/1_2/tools/autoopttool.so
  114. lib/avogadro/1_2/tools/autorotatetool.so
  115. lib/avogadro/1_2/tools/bondcentrictool.so
  116. lib/avogadro/1_2/tools/clickmeasuretool.so
  117. lib/avogadro/1_2/tools/drawtool.so
  118. lib/avogadro/1_2/tools/manipulatetool.so
  119. lib/avogadro/1_2/tools/selectrotatetool.so
  120. lib/avogadro/AvogadroConfig.cmake
  121. lib/avogadro/AvogadroConfigVersion.cmake
  122. lib/avogadro/AvogadroTargets-release.cmake
  123. lib/avogadro/AvogadroTargets.cmake
  124. lib/cmake/libmsym/libmsymConfig.cmake
  125. lib/cmake/libmsym/libmsymConfigVersion.cmake
  126. lib/cmake/libmsym/libmsymTargets-release.cmake
  127. lib/cmake/libmsym/libmsymTargets.cmake
  128. lib/libavogadro.so
  129. lib/libavogadro.so.1
  130. lib/libavogadro.so.1.2.0
  131. lib/libavogadro_OpenQube.so
  132. lib/libavogadro_OpenQube.so.0
  133. lib/libavogadro_OpenQube.so.0.1.0
  134. lib/libmsym.a
  135. lib/python2.7/site-packages/Avogadro.so
  136. libdata/pkgconfig/avogadro.pc
  137. man/man1/avogadro.1.gz
  138. man/man1/avopkg.1.gz
  139. share/applications/avogadro.desktop
  140. share/avogadro/builder/amino/d-ala.zmat
  141. share/avogadro/builder/amino/d-arg.zmat
  142. share/avogadro/builder/amino/d-asn.zmat
  143. share/avogadro/builder/amino/d-asp.zmat
  144. share/avogadro/builder/amino/d-cys.zmat
  145. share/avogadro/builder/amino/d-gln.zmat
  146. share/avogadro/builder/amino/d-glu.zmat
  147. share/avogadro/builder/amino/d-his.zmat
  148. share/avogadro/builder/amino/d-ile.zmat
  149. share/avogadro/builder/amino/d-leu.zmat
  150. share/avogadro/builder/amino/d-lys.zmat
  151. share/avogadro/builder/amino/d-met.zmat
  152. share/avogadro/builder/amino/d-phe.zmat
  153. share/avogadro/builder/amino/d-pro.zmat
  154. share/avogadro/builder/amino/d-ser.zmat
  155. share/avogadro/builder/amino/d-thr.zmat
  156. share/avogadro/builder/amino/d-trp.zmat
  157. share/avogadro/builder/amino/d-tyr.zmat
  158. share/avogadro/builder/amino/d-val.zmat
  159. share/avogadro/builder/amino/gly.zmat
  160. share/avogadro/builder/amino/l-ala.zmat
  161. share/avogadro/builder/amino/l-arg.zmat
  162. share/avogadro/builder/amino/l-asn.zmat
  163. share/avogadro/builder/amino/l-asp.zmat
  164. share/avogadro/builder/amino/l-cys.zmat
  165. share/avogadro/builder/amino/l-gln.zmat
  166. share/avogadro/builder/amino/l-glu.zmat
  167. share/avogadro/builder/amino/l-his.zmat
  168. share/avogadro/builder/amino/l-ile.zmat
  169. share/avogadro/builder/amino/l-leu.zmat
  170. share/avogadro/builder/amino/l-lys.zmat
  171. share/avogadro/builder/amino/l-met.zmat
  172. share/avogadro/builder/amino/l-phe.zmat
  173. share/avogadro/builder/amino/l-pro.zmat
  174. share/avogadro/builder/amino/l-pyl.zmat
  175. share/avogadro/builder/amino/l-sec.zmat
  176. share/avogadro/builder/amino/l-ser.zmat
  177. share/avogadro/builder/amino/l-thr.zmat
  178. share/avogadro/builder/amino/l-trp.zmat
  179. share/avogadro/builder/amino/l-tyr.zmat
  180. share/avogadro/builder/amino/l-val.zmat
  181. share/avogadro/crystals/antimonides/AlSb.cif
  182. share/avogadro/crystals/antimonides/GaSb.cif
  183. share/avogadro/crystals/antimonides/InSb.cif
  184. share/avogadro/crystals/arsenides/AlAs.cif
  185. share/avogadro/crystals/arsenides/BAs.cif
  186. share/avogadro/crystals/arsenides/Co.87Fe.11Ni.13As3-Skutterudite.cif
  187. share/avogadro/crystals/arsenides/CoAs3-Skutterudite.cif
  188. share/avogadro/crystals/arsenides/GaAs.cif
  189. share/avogadro/crystals/arsenides/InAs.cif
  190. share/avogadro/crystals/arsenides/NiAs-Nickeline.cif
  191. share/avogadro/crystals/carbides/SiC-2H-Moissanite.cif
  192. share/avogadro/crystals/carbides/SiC-3C-beta.cif
  193. share/avogadro/crystals/carbides/SiC-6H-alpha.cif
  194. share/avogadro/crystals/carbides/SiC-Moissanite.cif
  195. share/avogadro/crystals/carbides/SiC.cif
  196. share/avogadro/crystals/carbides/W2C.cif
  197. share/avogadro/crystals/carbides/WC.cif
  198. share/avogadro/crystals/carbonates/CaCO3-Calcite.cif
  199. share/avogadro/crystals/carbonates/CaMgC2O6-Dolomite.cif
  200. share/avogadro/crystals/carbonates/Li2CO3-Zabuyelite.cif
  201. share/avogadro/crystals/carbonates/MgCO3-Magnesite.cif
  202. share/avogadro/crystals/carbonates/Na2CO3-Natrite.cif
  203. share/avogadro/crystals/clays/Al2Si2O9H4-Dickite.cif
  204. share/avogadro/crystals/clays/Al2Si2O9H4-Kaolinite.cif
  205. share/avogadro/crystals/clays/Al2Si2O9H4-Nacrite.cif
  206. share/avogadro/crystals/clays/Al2Si4O12Ca0.5-Montmorillonite.cif
  207. share/avogadro/crystals/clays/Al4KSi2O12-Illite.cif
  208. share/avogadro/crystals/clays/AlSi2O6H-Pyrophyllite.cif
  209. share/avogadro/crystals/clays/Fe2.25Cl0.5H2.75-Fougerite.cif
  210. share/avogadro/crystals/clays/FeSi2O6H-Nontronite.cif
  211. share/avogadro/crystals/clays/Lepidolite.cif
  212. share/avogadro/crystals/clays/Mg2Al2SiO9H4-Amesite.cif
  213. share/avogadro/crystals/clays/Mg3(O12Si4)H2-Vermiculite.cif
  214. share/avogadro/crystals/clays/Mg4Si6O22.82H13.64-Sepiolite.cif
  215. share/avogadro/crystals/clays/Mn1.854Fe1.656Mg0.537Si0.953O9H4-Guidottiite.cif
  216. share/avogadro/crystals/clays/Zn2SiO5H2-Hemimorphite.cif
  217. share/avogadro/crystals/elements/Ac-Actinium.cif
  218. share/avogadro/crystals/elements/Ag-Silver.cif
  219. share/avogadro/crystals/elements/Al-Aluminum.cif
  220. share/avogadro/crystals/elements/Am-Americium.cif
  221. share/avogadro/crystals/elements/Ar-Argon.cif
  222. share/avogadro/crystals/elements/As-Arsenic.cif
  223. share/avogadro/crystals/elements/As-Arsenolamprite.cif
  224. share/avogadro/crystals/elements/Au-Gold.cif
  225. share/avogadro/crystals/elements/B-Boron.cif
  226. share/avogadro/crystals/elements/Ba-Barium.cif
  227. share/avogadro/crystals/elements/Be-Beryllium.cif
  228. share/avogadro/crystals/elements/Bi-Bismuth.cif
  229. share/avogadro/crystals/elements/Br-Bromine.cif
  230. share/avogadro/crystals/elements/C-Diamond.cif
  231. share/avogadro/crystals/elements/C-Graphite.cif
  232. share/avogadro/crystals/elements/C-Lonsdaleite.cif
  233. share/avogadro/crystals/elements/Ca-Calcium-alpha.cif
  234. share/avogadro/crystals/elements/Ca-Calcium-beta.cif
  235. share/avogadro/crystals/elements/Ca-Calcium-gamma.cif
  236. share/avogadro/crystals/elements/Cd-Cadmium.cif
  237. share/avogadro/crystals/elements/Ce-Cerium.cif
  238. share/avogadro/crystals/elements/Cl-Chlorine.cif
  239. share/avogadro/crystals/elements/Co-Cobalt.cif
  240. share/avogadro/crystals/elements/Cr-Chromium.cif
  241. share/avogadro/crystals/elements/Cs-Cesium.cif
  242. share/avogadro/crystals/elements/Cu-Copper.cif
  243. share/avogadro/crystals/elements/Dy-Dysprosium.cif
  244. share/avogadro/crystals/elements/Er-Erbium.cif
  245. share/avogadro/crystals/elements/Eu-Europium.cif
  246. share/avogadro/crystals/elements/Fe-Iron-alpha.cif
  247. share/avogadro/crystals/elements/Fe-Iron-beta.cif
  248. share/avogadro/crystals/elements/Fe-Iron-delta.cif
  249. share/avogadro/crystals/elements/Fe-Iron-gamma.cif
  250. share/avogadro/crystals/elements/Ga-Gallium.cif
  251. share/avogadro/crystals/elements/Gd-Gadolinium.cif
  252. share/avogadro/crystals/elements/Ge-Germanium.cif
  253. share/avogadro/crystals/elements/He-Helium.cif
  254. share/avogadro/crystals/elements/Hf-Hafnium.cif
  255. share/avogadro/crystals/elements/Ho-Holmium.cif
  256. share/avogadro/crystals/elements/I-Iodine.cif
  257. share/avogadro/crystals/elements/In-Indium.cif
  258. share/avogadro/crystals/elements/Ir-Iridium.cif
  259. share/avogadro/crystals/elements/K-Potassium.cif
  260. share/avogadro/crystals/elements/Kr-Krypton.cif
  261. share/avogadro/crystals/elements/La-Lanthanum.cif
  262. share/avogadro/crystals/elements/Li-Lithium.cif
  263. share/avogadro/crystals/elements/Lu-Lutetium.cif
  264. share/avogadro/crystals/elements/Mg-Magnesium.cif
  265. share/avogadro/crystals/elements/Mn-Manganese-alpha.cif
  266. share/avogadro/crystals/elements/Mn-Manganese-delta.cif
  267. share/avogadro/crystals/elements/Mn-Manganese-gamma.cif
  268. share/avogadro/crystals/elements/Mo-Molybdenum.cif
  269. share/avogadro/crystals/elements/N-Nitrogen.cif
  270. share/avogadro/crystals/elements/Na-Sodium.cif
  271. share/avogadro/crystals/elements/Nb-Niobium.cif
  272. share/avogadro/crystals/elements/Nd-Neodymium.cif
  273. share/avogadro/crystals/elements/Ne-Neon.cif
  274. share/avogadro/crystals/elements/Ni-Nickel.cif
  275. share/avogadro/crystals/elements/Np-Neptunium-alpha.cif
  276. share/avogadro/crystals/elements/Np-Neptunium-beta.cif
  277. share/avogadro/crystals/elements/Np-Neptunium-gamma.cif
  278. share/avogadro/crystals/elements/Os-Osmium.cif
  279. share/avogadro/crystals/elements/P-Phosphorus-black.cif
  280. share/avogadro/crystals/elements/P-Phosphorus.cif
  281. share/avogadro/crystals/elements/Pb-Lead.cif
  282. share/avogadro/crystals/elements/Pd-Palladium.cif
  283. share/avogadro/crystals/elements/Pr-Praseodymium.cif
  284. share/avogadro/crystals/elements/Pt-Platinum.cif
  285. share/avogadro/crystals/elements/Pu-Plutonium-alpha.cif
  286. share/avogadro/crystals/elements/Pu-Plutonium-epsilon.cif
  287. share/avogadro/crystals/elements/Pu-Plutonium-gamma.cif
  288. share/avogadro/crystals/elements/Rb-Rubidium.cif
  289. share/avogadro/crystals/elements/Re-Rhenium.cif
  290. share/avogadro/crystals/elements/Rh-Rhodium.cif
  291. share/avogadro/crystals/elements/Ru-Ruthenium.cif
  292. share/avogadro/crystals/elements/S6-Sulfur.cif
  293. share/avogadro/crystals/elements/S8-Sulfur-alpha.cif
  294. share/avogadro/crystals/elements/S8-Sulfur-beta.cif
  295. share/avogadro/crystals/elements/S8-Sulfur-gamma.cif
  296. share/avogadro/crystals/elements/Sb-Antimony.cif
  297. share/avogadro/crystals/elements/Sc-Scandium.cif
  298. share/avogadro/crystals/elements/Se-Selenium.cif
  299. share/avogadro/crystals/elements/Si-Silicon.cif
  300. share/avogadro/crystals/elements/Sm-Samarium.cif
  301. share/avogadro/crystals/elements/Sn-Tin-alpha.cif
  302. share/avogadro/crystals/elements/Sn-Tin-beta.cif
  303. share/avogadro/crystals/elements/Sr-Strontium.cif
  304. share/avogadro/crystals/elements/Ta-Tantalum.cif
  305. share/avogadro/crystals/elements/Tb-Terbium.cif
  306. share/avogadro/crystals/elements/Te-Tellurium.cif
  307. share/avogadro/crystals/elements/Th-Thorium.cif
  308. share/avogadro/crystals/elements/Ti-Titanium-alpha.cif
  309. share/avogadro/crystals/elements/Ti-Titanium-beta.cif
  310. share/avogadro/crystals/elements/Tl-Thallium.cif
  311. share/avogadro/crystals/elements/Tm-Thulium.cif
  312. share/avogadro/crystals/elements/U-Uranium-alpha.cif
  313. share/avogadro/crystals/elements/U-Uranium-gamma.cif
  314. share/avogadro/crystals/elements/V-Vanadium.cif
  315. share/avogadro/crystals/elements/W-Tungsten.cif
  316. share/avogadro/crystals/elements/Xe-Xenon.cif
  317. share/avogadro/crystals/elements/Y-Yttrium.cif
  318. share/avogadro/crystals/elements/Yb-Ytterbium.cif
  319. share/avogadro/crystals/elements/Zn-Zinc.cif
  320. share/avogadro/crystals/elements/Zr-Zirconium.cif
  321. share/avogadro/crystals/halides/AgBr-Bromargyrite.cif
  322. share/avogadro/crystals/halides/AgCl-Chlorargyrite.cif
  323. share/avogadro/crystals/halides/AlCl3.cif
  324. share/avogadro/crystals/halides/AlNa3F6-Cryolite.cif
  325. share/avogadro/crystals/halides/CaF2-Fluorite.cif
  326. share/avogadro/crystals/halides/CdCl2.cif
  327. share/avogadro/crystals/halides/CdI2.cif
  328. share/avogadro/crystals/halides/CrCl2.cif
  329. share/avogadro/crystals/halides/CrCl3.cif
  330. share/avogadro/crystals/halides/CsCl.cif
  331. share/avogadro/crystals/halides/FeCl3-Molysite.cif
  332. share/avogadro/crystals/halides/HgCl-Calomel.cif
  333. share/avogadro/crystals/halides/KBr.cif
  334. share/avogadro/crystals/halides/KCl-Sylvite.cif
  335. share/avogadro/crystals/halides/NaCl-Halite.cif
  336. share/avogadro/crystals/halides/PbFCl-Matlockite.cif
  337. share/avogadro/crystals/hydrides/KH.cif
  338. share/avogadro/crystals/hydrides/LiH.cif
  339. share/avogadro/crystals/hydrides/NaH.cif
  340. share/avogadro/crystals/hydrides/PdH.cif
  341. share/avogadro/crystals/hydroxides/Ca(OH)2-Portlandite.cif
  342. share/avogadro/crystals/hydroxides/KOH.cif
  343. share/avogadro/crystals/hydroxides/LiOH.cif
  344. share/avogadro/crystals/hydroxides/Mg(OH)2-Brucite.cif
  345. share/avogadro/crystals/hydroxides/Ni(OH)2-Theophrastite.cif
  346. share/avogadro/crystals/ice/H2O-Ice-II.cif
  347. share/avogadro/crystals/ice/H2O-Ice-III.cif
  348. share/avogadro/crystals/ice/H2O-Ice-IV.cif
  349. share/avogadro/crystals/ice/H2O-Ice-Ih.cif
  350. share/avogadro/crystals/ice/H2O-Ice-VI.cif
  351. share/avogadro/crystals/ice/H2O-Ice-VII.cif
  352. share/avogadro/crystals/ice/H2O-Ice.cif
  353. share/avogadro/crystals/intermetallics/(Cu0.5Fe0.5)Pt-Tulameenite.cif
  354. share/avogadro/crystals/intermetallics/(Ni0.5Fe0.5)Pt-Ferronickelplatinum.cif
  355. share/avogadro/crystals/intermetallics/Au3Cu-Bogdanovite.cif
  356. share/avogadro/crystals/intermetallics/AuCu-Tetraauricupride.cif
  357. share/avogadro/crystals/intermetallics/BiPd-Sobolevskite.cif
  358. share/avogadro/crystals/intermetallics/CoFe-Wairauite.cif
  359. share/avogadro/crystals/intermetallics/Cu2MnAl-Heusler.cif
  360. share/avogadro/crystals/intermetallics/FePt-Tetraferroplatinum.cif
  361. share/avogadro/crystals/intermetallics/PtBi.cif
  362. share/avogadro/crystals/nitrides/AlN.cif
  363. share/avogadro/crystals/nitrides/BN.cif
  364. share/avogadro/crystals/nitrides/GaN.cif
  365. share/avogadro/crystals/nitrides/InN.cif
  366. share/avogadro/crystals/nitrides/Si3N4-beta.cif
  367. share/avogadro/crystals/other/(NH4)MgPO4-6(H2O)-Struvite.cif
  368. share/avogadro/crystals/other/C10H10Fe-Ferrocene.cif
  369. share/avogadro/crystals/other/Ca2C4O10H2.57-Oxalate-Whewellite.cif
  370. share/avogadro/crystals/other/CaC2O6.375H6-Oxalate-Weddellite.cif
  371. share/avogadro/crystals/other/FeMnO3-Bixbyite.cif
  372. share/avogadro/crystals/other/H3N-Ammonia.cif
  373. share/avogadro/crystals/other/LaAlO3.cif
  374. share/avogadro/crystals/other/LiNbO3-LithiumNiobate.cif
  375. share/avogadro/crystals/other/Pb1Ti0.35Zr0.65O3-PZT-cub.cif
  376. share/avogadro/crystals/other/Pb1Ti0.35Zr0.65O3-PZT-rhomb.cif
  377. share/avogadro/crystals/other/YBa2Cu3O6.9-YBCO.cif
  378. share/avogadro/crystals/oxides/(MgAl2)O4-Spinel.cif
  379. share/avogadro/crystals/oxides/Ag2O.cif
  380. share/avogadro/crystals/oxides/AgO.cif
  381. share/avogadro/crystals/oxides/Al2O3-Corundum.cif
  382. share/avogadro/crystals/oxides/BaO.cif
  383. share/avogadro/crystals/oxides/CaO-Lime.cif
  384. share/avogadro/crystals/oxides/CdO-Monteponite.cif
  385. share/avogadro/crystals/oxides/CeO2-Cerianite.cif
  386. share/avogadro/crystals/oxides/CoFe2O4.cif
  387. share/avogadro/crystals/oxides/CoO.cif
  388. share/avogadro/crystals/oxides/Cr2O3-Eskolaite.cif
  389. share/avogadro/crystals/oxides/Cu2O-Cuprite.cif
  390. share/avogadro/crystals/oxides/CuO-Tenorite.cif
  391. share/avogadro/crystals/oxides/Fe2O3-Hematite.cif
  392. share/avogadro/crystals/oxides/Fe3O4-Magnetite.cif
  393. share/avogadro/crystals/oxides/FeO-Wustite.cif
  394. share/avogadro/crystals/oxides/GeO2-Argutite-tetrag.cif
  395. share/avogadro/crystals/oxides/GeO2-Argutite.cif
  396. share/avogadro/crystals/oxides/GeO2.cif
  397. share/avogadro/crystals/oxides/HfO2.cif
  398. share/avogadro/crystals/oxides/In2O3-IndiumOxide.cif
  399. share/avogadro/crystals/oxides/In2O3.cif
  400. share/avogadro/crystals/oxides/IrO2.cif
  401. share/avogadro/crystals/oxides/K2O.cif
  402. share/avogadro/crystals/oxides/La2O3-LanthanumOxide-A.cif
  403. share/avogadro/crystals/oxides/Li2O.cif
  404. share/avogadro/crystals/oxides/MgO-Periclase.cif
  405. share/avogadro/crystals/oxides/MnO-Manganosite.cif
  406. share/avogadro/crystals/oxides/MnO2-Pyrolusite.cif
  407. share/avogadro/crystals/oxides/MoO2-Tugarinovite.cif
  408. share/avogadro/crystals/oxides/MoO3-Molybdite.cif
  409. share/avogadro/crystals/oxides/Na2O.cif
  410. share/avogadro/crystals/oxides/NbO.cif
  411. share/avogadro/crystals/oxides/NbO2.cif
  412. share/avogadro/crystals/oxides/NiFe2O4.cif
  413. share/avogadro/crystals/oxides/NiO-Bunsenite.cif
  414. share/avogadro/crystals/oxides/PbO.cif
  415. share/avogadro/crystals/oxides/PbO2-Scrutinyite.cif
  416. share/avogadro/crystals/oxides/PdO.cif
  417. share/avogadro/crystals/oxides/PtO2-beta.cif
  418. share/avogadro/crystals/oxides/Rb2O.cif
  419. share/avogadro/crystals/oxides/Rh2O3.cif
  420. share/avogadro/crystals/oxides/RuO2.cif
  421. share/avogadro/crystals/oxides/Sc2O3.cif
  422. share/avogadro/crystals/oxides/SiO2-Coesite.cif
  423. share/avogadro/crystals/oxides/SiO2-Cristobalite.cif
  424. share/avogadro/crystals/oxides/SiO2-Quartz-alpha.cif
  425. share/avogadro/crystals/oxides/SiO2-Quartz-beta.cif
  426. share/avogadro/crystals/oxides/SiO2-Stishovite.cif
  427. share/avogadro/crystals/oxides/SmO.cif
  428. share/avogadro/crystals/oxides/SnO.cif
  429. share/avogadro/crystals/oxides/SnO2-Cassiterite.cif
  430. share/avogadro/crystals/oxides/SrO.cif
  431. share/avogadro/crystals/oxides/TaO.cif
  432. share/avogadro/crystals/oxides/TiO2-Anatase.cif
  433. share/avogadro/crystals/oxides/TiO2-Brookite.cif
  434. share/avogadro/crystals/oxides/TiO2-Rutile.cif
  435. share/avogadro/crystals/oxides/UO.cif
  436. share/avogadro/crystals/oxides/UO2-Uraninite.cif
  437. share/avogadro/crystals/oxides/V2O3-Karelianite.cif
  438. share/avogadro/crystals/oxides/V2O5-Shcherbinaite.cif
  439. share/avogadro/crystals/oxides/VO.cif
  440. share/avogadro/crystals/oxides/VO2.cif
  441. share/avogadro/crystals/oxides/WO2.cif
  442. share/avogadro/crystals/oxides/Y2O3.cif
  443. share/avogadro/crystals/oxides/YbO.cif
  444. share/avogadro/crystals/oxides/ZnO-Zincite.cif
  445. share/avogadro/crystals/oxides/ZrO.cif
  446. share/avogadro/crystals/oxides/ZrO2-Cubic.cif
  447. share/avogadro/crystals/phosphides/AlP.cif
  448. share/avogadro/crystals/phosphides/BP.cif
  449. share/avogadro/crystals/phosphides/GaP.cif
  450. share/avogadro/crystals/phosphides/InP.cif
  451. share/avogadro/crystals/selenides/Bi2Se3.cif
  452. share/avogadro/crystals/selenides/BiSe.cif
  453. share/avogadro/crystals/selenides/CdSe-Cadmoselite.cif
  454. share/avogadro/crystals/selenides/HgSe-Tiemannite.cif
  455. share/avogadro/crystals/selenides/PbSe-Clausthalite.cif
  456. share/avogadro/crystals/selenides/Sb2Se3-Antimonselite.cif
  457. share/avogadro/crystals/selenides/ZnSe.cif
  458. share/avogadro/crystals/silicates/Be3Al2(SiO3)6-Beryl.cif
  459. share/avogadro/crystals/sulfates/BaSO4-Barite.cif
  460. share/avogadro/crystals/sulfates/CaSO4-2(H2O)-Gypsum.cif
  461. share/avogadro/crystals/sulfates/CaSO4-Anhydrite.cif
  462. share/avogadro/crystals/sulfates/CoSO4.cif
  463. share/avogadro/crystals/sulfates/CuSO4.cif
  464. share/avogadro/crystals/sulfates/MgSO4.cif
  465. share/avogadro/crystals/sulfates/PbSO4-Anglesite.cif
  466. share/avogadro/crystals/sulfates/SrSO4-Celestine.cif
  467. share/avogadro/crystals/sulfides/Bi2S3-Bismuthinite.cif
  468. share/avogadro/crystals/sulfides/CdS-Greenockite.cif
  469. share/avogadro/crystals/sulfides/CdS-Hawleyite.cif
  470. share/avogadro/crystals/sulfides/FeS.cif
  471. share/avogadro/crystals/sulfides/FeS2-Pyrite.cif
  472. share/avogadro/crystals/sulfides/HgS-Metacinnabar.cif
  473. share/avogadro/crystals/sulfides/PbS-Galena.cif
  474. share/avogadro/crystals/sulfides/Sb2S3-Stibnite.cif
  475. share/avogadro/crystals/sulfides/SnS-Herzenbergite.cif
  476. share/avogadro/crystals/sulfides/ZnS-Sphalerite.cif
  477. share/avogadro/crystals/sulfides/ZnS-Wurtzite-2H.cif
  478. share/avogadro/crystals/sulfides/ZnS-Zincblende.cif
  479. share/avogadro/crystals/telurides/Bi2Te3.cif
  480. share/avogadro/crystals/telurides/BiTe.cif
  481. share/avogadro/crystals/telurides/CdTe.cif
  482. share/avogadro/crystals/telurides/PbTe-Altaite.cif
  483. share/avogadro/crystals/telurides/ZnTe.cif
  484. share/avogadro/crystals/titanates/BaTiO3.cif
  485. share/avogadro/crystals/titanates/CaTiO3-Perovskite.cif
  486. share/avogadro/crystals/titanates/Mg2TiO4-Qandilite-cubic.cif
  487. share/avogadro/crystals/titanates/Mg2TiO4-Qandilite-tetrag.cif
  488. share/avogadro/crystals/titanates/MgTiO3.cif
  489. share/avogadro/crystals/titanates/SrTiO3-Tausonite.cif
  490. share/avogadro/crystals/zeolites/ABW.cif
  491. share/avogadro/crystals/zeolites/ACO.cif
  492. share/avogadro/crystals/zeolites/AEI.cif
  493. share/avogadro/crystals/zeolites/AEL.cif
  494. share/avogadro/crystals/zeolites/AEN.cif
  495. share/avogadro/crystals/zeolites/AET.cif
  496. share/avogadro/crystals/zeolites/AFG.cif
  497. share/avogadro/crystals/zeolites/AFI.cif
  498. share/avogadro/crystals/zeolites/AFN.cif
  499. share/avogadro/crystals/zeolites/AFO.cif
  500. share/avogadro/crystals/zeolites/AFR.cif
  501. share/avogadro/crystals/zeolites/AFS.cif
  502. share/avogadro/crystals/zeolites/AFT.cif
  503. share/avogadro/crystals/zeolites/AFX.cif
  504. share/avogadro/crystals/zeolites/AFY.cif
  505. share/avogadro/crystals/zeolites/AHT.cif
  506. share/avogadro/crystals/zeolites/ANA.cif
  507. share/avogadro/crystals/zeolites/APC.cif
  508. share/avogadro/crystals/zeolites/APD.cif
  509. share/avogadro/crystals/zeolites/AST.cif
  510. share/avogadro/crystals/zeolites/ASV.cif
  511. share/avogadro/crystals/zeolites/ATN.cif
  512. share/avogadro/crystals/zeolites/ATO.cif
  513. share/avogadro/crystals/zeolites/ATS.cif
  514. share/avogadro/crystals/zeolites/ATT.cif
  515. share/avogadro/crystals/zeolites/ATV.cif
  516. share/avogadro/crystals/zeolites/AWO.cif
  517. share/avogadro/crystals/zeolites/AWW.cif
  518. share/avogadro/crystals/zeolites/BCT.cif
  519. share/avogadro/crystals/zeolites/BEA.cif
  520. share/avogadro/crystals/zeolites/BEC.cif
  521. share/avogadro/crystals/zeolites/BIK.cif
  522. share/avogadro/crystals/zeolites/BOF.cif
  523. share/avogadro/crystals/zeolites/BOG.cif
  524. share/avogadro/crystals/zeolites/BPH.cif
  525. share/avogadro/crystals/zeolites/BRE.cif
  526. share/avogadro/crystals/zeolites/BSV.cif
  527. share/avogadro/crystals/zeolites/CAN.cif
  528. share/avogadro/crystals/zeolites/CAS.cif
  529. share/avogadro/crystals/zeolites/CDO.cif
  530. share/avogadro/crystals/zeolites/CFI.cif
  531. share/avogadro/crystals/zeolites/CGF.cif
  532. share/avogadro/crystals/zeolites/CGS.cif
  533. share/avogadro/crystals/zeolites/CHA.cif
  534. share/avogadro/crystals/zeolites/CHI.cif
  535. share/avogadro/crystals/zeolites/CLO.cif
  536. share/avogadro/crystals/zeolites/CON.cif
  537. share/avogadro/crystals/zeolites/CZP.cif
  538. share/avogadro/crystals/zeolites/DAC.cif
  539. share/avogadro/crystals/zeolites/DDR.cif
  540. share/avogadro/crystals/zeolites/DFO.cif
  541. share/avogadro/crystals/zeolites/DFT.cif
  542. share/avogadro/crystals/zeolites/DOH.cif
  543. share/avogadro/crystals/zeolites/DON.cif
  544. share/avogadro/crystals/zeolites/EAB.cif
  545. share/avogadro/crystals/zeolites/EDI.cif
  546. share/avogadro/crystals/zeolites/EMT.cif
  547. share/avogadro/crystals/zeolites/EON.cif
  548. share/avogadro/crystals/zeolites/EPI.cif
  549. share/avogadro/crystals/zeolites/ERI.cif
  550. share/avogadro/crystals/zeolites/ESV.cif
  551. share/avogadro/crystals/zeolites/ETR.cif
  552. share/avogadro/crystals/zeolites/EUO.cif
  553. share/avogadro/crystals/zeolites/EZT.cif
  554. share/avogadro/crystals/zeolites/FAR.cif
  555. share/avogadro/crystals/zeolites/FAU.cif
  556. share/avogadro/crystals/zeolites/FER.cif
  557. share/avogadro/crystals/zeolites/FRA.cif
  558. share/avogadro/crystals/zeolites/GIS.cif
  559. share/avogadro/crystals/zeolites/GIU.cif
  560. share/avogadro/crystals/zeolites/GME.cif
  561. share/avogadro/crystals/zeolites/GON.cif
  562. share/avogadro/crystals/zeolites/GOO.cif
  563. share/avogadro/crystals/zeolites/HEU.cif
  564. share/avogadro/crystals/zeolites/IFR.cif
  565. share/avogadro/crystals/zeolites/IHW.cif
  566. share/avogadro/crystals/zeolites/IMF.cif
  567. share/avogadro/crystals/zeolites/IRR.cif
  568. share/avogadro/crystals/zeolites/ISV.cif
  569. share/avogadro/crystals/zeolites/ITE.cif
  570. share/avogadro/crystals/zeolites/ITH.cif
  571. share/avogadro/crystals/zeolites/ITR.cif
  572. share/avogadro/crystals/zeolites/ITV.cif
  573. share/avogadro/crystals/zeolites/ITW.cif
  574. share/avogadro/crystals/zeolites/IWR.cif
  575. share/avogadro/crystals/zeolites/IWS.cif
  576. share/avogadro/crystals/zeolites/IWV.cif
  577. share/avogadro/crystals/zeolites/IWW.cif
  578. share/avogadro/crystals/zeolites/JBW.cif
  579. share/avogadro/crystals/zeolites/JRY.cif
  580. share/avogadro/crystals/zeolites/KFI.cif
  581. share/avogadro/crystals/zeolites/LAU.cif
  582. share/avogadro/crystals/zeolites/LEV.cif
  583. share/avogadro/crystals/zeolites/LIO.cif
  584. share/avogadro/crystals/zeolites/LIT.cif
  585. share/avogadro/crystals/zeolites/LOS.cif
  586. share/avogadro/crystals/zeolites/LOV.cif
  587. share/avogadro/crystals/zeolites/LTA.cif
  588. share/avogadro/crystals/zeolites/LTF.cif
  589. share/avogadro/crystals/zeolites/LTL.cif
  590. share/avogadro/crystals/zeolites/LTN.cif
  591. share/avogadro/crystals/zeolites/MAR.cif
  592. share/avogadro/crystals/zeolites/MAZ.cif
  593. share/avogadro/crystals/zeolites/MEI.cif
  594. share/avogadro/crystals/zeolites/MEL.cif
  595. share/avogadro/crystals/zeolites/MEP.cif
  596. share/avogadro/crystals/zeolites/MER.cif
  597. share/avogadro/crystals/zeolites/MFI.cif
  598. share/avogadro/crystals/zeolites/MFS.cif
  599. share/avogadro/crystals/zeolites/MON.cif
  600. share/avogadro/crystals/zeolites/MOR.cif
  601. share/avogadro/crystals/zeolites/MOZ.cif
  602. share/avogadro/crystals/zeolites/MRE.cif
  603. share/avogadro/crystals/zeolites/MSE.cif
  604. share/avogadro/crystals/zeolites/MSO.cif
  605. share/avogadro/crystals/zeolites/MTF.cif
  606. share/avogadro/crystals/zeolites/MTN.cif
  607. share/avogadro/crystals/zeolites/MTT.cif
  608. share/avogadro/crystals/zeolites/MTW.cif
  609. share/avogadro/crystals/zeolites/MVY.cif
  610. share/avogadro/crystals/zeolites/MWW.cif
  611. share/avogadro/crystals/zeolites/NAB.cif
  612. share/avogadro/crystals/zeolites/NAT.cif
  613. share/avogadro/crystals/zeolites/NES.cif
  614. share/avogadro/crystals/zeolites/NON.cif
  615. share/avogadro/crystals/zeolites/NPO.cif
  616. share/avogadro/crystals/zeolites/NSI.cif
  617. share/avogadro/crystals/zeolites/OBW.cif
  618. share/avogadro/crystals/zeolites/OFF.cif
  619. share/avogadro/crystals/zeolites/OSI.cif
  620. share/avogadro/crystals/zeolites/OSO.cif
  621. share/avogadro/crystals/zeolites/OWE.cif
  622. share/avogadro/crystals/zeolites/PAR.cif
  623. share/avogadro/crystals/zeolites/PAU.cif
  624. share/avogadro/crystals/zeolites/PHI.cif
  625. share/avogadro/crystals/zeolites/PON.cif
  626. share/avogadro/crystals/zeolites/PUN.cif
  627. share/avogadro/crystals/zeolites/RHO.cif
  628. share/avogadro/crystals/zeolites/RON.cif
  629. share/avogadro/crystals/zeolites/RRO.cif
  630. share/avogadro/crystals/zeolites/RSN.cif
  631. share/avogadro/crystals/zeolites/RTE.cif
  632. share/avogadro/crystals/zeolites/RTH.cif
  633. share/avogadro/crystals/zeolites/RUT.cif
  634. share/avogadro/crystals/zeolites/RWR.cif
  635. share/avogadro/crystals/zeolites/RWY.cif
  636. share/avogadro/crystals/zeolites/SAF.cif
  637. share/avogadro/crystals/zeolites/SAO.cif
  638. share/avogadro/crystals/zeolites/SAS.cif
  639. share/avogadro/crystals/zeolites/SAT.cif
  640. share/avogadro/crystals/zeolites/SAV.cif
  641. share/avogadro/crystals/zeolites/SBE.cif
  642. share/avogadro/crystals/zeolites/SBN.cif
  643. share/avogadro/crystals/zeolites/SBS.cif
  644. share/avogadro/crystals/zeolites/SBT.cif
  645. share/avogadro/crystals/zeolites/SFE.cif
  646. share/avogadro/crystals/zeolites/SFF.cif
  647. share/avogadro/crystals/zeolites/SFG.cif
  648. share/avogadro/crystals/zeolites/SFH.cif
  649. share/avogadro/crystals/zeolites/SFN.cif
  650. share/avogadro/crystals/zeolites/SFO.cif
  651. share/avogadro/crystals/zeolites/SFS.cif
  652. share/avogadro/crystals/zeolites/SGT.cif
  653. share/avogadro/crystals/zeolites/SIV.cif
  654. share/avogadro/crystals/zeolites/SOD.cif
  655. share/avogadro/crystals/zeolites/SOF.cif
  656. share/avogadro/crystals/zeolites/SOS.cif
  657. share/avogadro/crystals/zeolites/SSF.cif
  658. share/avogadro/crystals/zeolites/SSY.cif
  659. share/avogadro/crystals/zeolites/STF.cif
  660. share/avogadro/crystals/zeolites/STI.cif
  661. share/avogadro/crystals/zeolites/STO.cif
  662. share/avogadro/crystals/zeolites/STT.cif
  663. share/avogadro/crystals/zeolites/STW.cif
  664. share/avogadro/crystals/zeolites/SVR.cif
  665. share/avogadro/crystals/zeolites/SZR.cif
  666. share/avogadro/crystals/zeolites/TER.cif
  667. share/avogadro/crystals/zeolites/THO.cif
  668. share/avogadro/crystals/zeolites/TOL.cif
  669. share/avogadro/crystals/zeolites/TON.cif
  670. share/avogadro/crystals/zeolites/TSC.cif
  671. share/avogadro/crystals/zeolites/TUN.cif
  672. share/avogadro/crystals/zeolites/UEI.cif
  673. share/avogadro/crystals/zeolites/UFI.cif
  674. share/avogadro/crystals/zeolites/UOS.cif
  675. share/avogadro/crystals/zeolites/UOZ.cif
  676. share/avogadro/crystals/zeolites/USI.cif
  677. share/avogadro/crystals/zeolites/UTL.cif
  678. share/avogadro/crystals/zeolites/UWY.cif
  679. share/avogadro/crystals/zeolites/VET.cif
  680. share/avogadro/crystals/zeolites/VFI.cif
  681. share/avogadro/crystals/zeolites/VNI.cif
  682. share/avogadro/crystals/zeolites/VSV.cif
  683. share/avogadro/crystals/zeolites/WEI.cif
  684. share/avogadro/crystals/zeolites/WEN.cif
  685. share/avogadro/crystals/zeolites/YUG.cif
  686. share/avogadro/crystals/zeolites/ZON.cif
  687. share/avogadro/crystals/zeolites/ZSM-5.cif
  688. share/avogadro/fragments/alcohols/2-aminoethanol.cml
  689. share/avogadro/fragments/alcohols/but-2-yne-1_4-diol.cml
  690. share/avogadro/fragments/alcohols/cyclohexanol.cml
  691. share/avogadro/fragments/alcohols/cyclopentanol.cml
  692. share/avogadro/fragments/alcohols/ethane-1_2-diol.cml
  693. share/avogadro/fragments/alcohols/ethanol.cml
  694. share/avogadro/fragments/alcohols/methanol.cml
  695. share/avogadro/fragments/alcohols/propan-1-ol.cml
  696. share/avogadro/fragments/alcohols/propan-2-ol.cml
  697. share/avogadro/fragments/alcohols/propane-1_2_3-triol.cml
  698. share/avogadro/fragments/aldehydes/acetaldehyde.cml
  699. share/avogadro/fragments/aldehydes/formaldehyde.cml
  700. share/avogadro/fragments/alkanes/2-methylpropane.cml
  701. share/avogadro/fragments/alkanes/butane.cml
  702. share/avogadro/fragments/alkanes/decane.cml
  703. share/avogadro/fragments/alkanes/dodecane.cml
  704. share/avogadro/fragments/alkanes/eicosane.cml
  705. share/avogadro/fragments/alkanes/ethane.cml
  706. share/avogadro/fragments/alkanes/heptane.cml
  707. share/avogadro/fragments/alkanes/hexadecane.cml
  708. share/avogadro/fragments/alkanes/hexane.cml
  709. share/avogadro/fragments/alkanes/methane.cml
  710. share/avogadro/fragments/alkanes/nonane.cml
  711. share/avogadro/fragments/alkanes/octane.cml
  712. share/avogadro/fragments/alkanes/pentadecane.cml
  713. share/avogadro/fragments/alkanes/pentane.cml
  714. share/avogadro/fragments/alkanes/propane.cml
  715. share/avogadro/fragments/alkanes/tetracosane.cml
  716. share/avogadro/fragments/alkanes/tetradecane.cml
  717. share/avogadro/fragments/alkanes/tridecane.cml
  718. share/avogadro/fragments/alkanes/undecane.cml
  719. share/avogadro/fragments/alkenes/2-methylbut-2-ene.cml
  720. share/avogadro/fragments/alkenes/2-methylbuta-1_3-diene.cml
  721. share/avogadro/fragments/alkenes/3E-penta-1_3-diene.cml
  722. share/avogadro/fragments/alkenes/3Z-penta-1_3-diene.cml
  723. share/avogadro/fragments/alkenes/3Z_3-ethylhepta-1_3-diene.cml
  724. share/avogadro/fragments/alkenes/E-but-2-ene.cml
  725. share/avogadro/fragments/alkenes/E-hept-2-ene.cml
  726. share/avogadro/fragments/alkenes/E-hept-3-ene.cml
  727. share/avogadro/fragments/alkenes/E-hex-2-ene.cml
  728. share/avogadro/fragments/alkenes/E-hex-3-ene.cml
  729. share/avogadro/fragments/alkenes/E-oct-2-ene.cml
  730. share/avogadro/fragments/alkenes/E-oct-3-ene.cml
  731. share/avogadro/fragments/alkenes/E-oct-4-ene.cml
  732. share/avogadro/fragments/alkenes/E-pent-2-ene.cml
  733. share/avogadro/fragments/alkenes/Z-but-2-ene.cml
  734. share/avogadro/fragments/alkenes/Z-hept-2-ene.cml
  735. share/avogadro/fragments/alkenes/Z-hept-3-ene.cml
  736. share/avogadro/fragments/alkenes/Z-hex-2-ene.cml
  737. share/avogadro/fragments/alkenes/Z-hex-3-ene.cml
  738. share/avogadro/fragments/alkenes/Z-oct-2-ene.cml
  739. share/avogadro/fragments/alkenes/Z-oct-3-ene.cml
  740. share/avogadro/fragments/alkenes/Z-oct-4-ene.cml
  741. share/avogadro/fragments/alkenes/Z-pent-2-ene.cml
  742. share/avogadro/fragments/alkenes/but-1-ene.cml
  743. share/avogadro/fragments/alkenes/ethene.cml
  744. share/avogadro/fragments/alkenes/hept-1-ene.cml
  745. share/avogadro/fragments/alkenes/hex-1-ene.cml
  746. share/avogadro/fragments/alkenes/oct-1-ene.cml
  747. share/avogadro/fragments/alkenes/pent-1-ene.cml
  748. share/avogadro/fragments/alkenes/propene.cml
  749. share/avogadro/fragments/alkynes/acetylene.cml
  750. share/avogadro/fragments/alkynes/propyne.cml
  751. share/avogadro/fragments/amides/N_N-dimethylacetamide.cml
  752. share/avogadro/fragments/amides/N_N-dimethylformamide.cml
  753. share/avogadro/fragments/amides/acetamide.cml
  754. share/avogadro/fragments/amides/ethyl_carbamate.cml
  755. share/avogadro/fragments/amides/oxamide.cml
  756. share/avogadro/fragments/amines/1H-azepine.cml
  757. share/avogadro/fragments/amines/2-aminopropane.cml
  758. share/avogadro/fragments/amines/S-sec-butylamine.cml
  759. share/avogadro/fragments/amines/ammonia.cml
  760. share/avogadro/fragments/amines/azepane.cml
  761. share/avogadro/fragments/amines/diethylamine.cml
  762. share/avogadro/fragments/amines/dimethylamine.cml
  763. share/avogadro/fragments/amines/ethylamine.cml
  764. share/avogadro/fragments/amines/methylamine.cml
  765. share/avogadro/fragments/amines/piperazine.cml
  766. share/avogadro/fragments/amines/piperidine.cml
  767. share/avogadro/fragments/amines/pyrrolidine.cml
  768. share/avogadro/fragments/amines/tert-butylamine.cml
  769. share/avogadro/fragments/amines/triethylamine.cml
  770. share/avogadro/fragments/amines/triethylenediamine.cml
  771. share/avogadro/fragments/amines/trimethylamine.cml
  772. share/avogadro/fragments/amino_acids/D-alanine.cml
  773. share/avogadro/fragments/amino_acids/D-allo-threonine.cml
  774. share/avogadro/fragments/amino_acids/D-arginine.cml
  775. share/avogadro/fragments/amino_acids/D-asparagine.cml
  776. share/avogadro/fragments/amino_acids/D-aspartic_acid.cml
  777. share/avogadro/fragments/amino_acids/D-cysteine.cml
  778. share/avogadro/fragments/amino_acids/D-glutamic_acid.cml
  779. share/avogadro/fragments/amino_acids/D-glutamine.cml
  780. share/avogadro/fragments/amino_acids/D-histidine.cml
  781. share/avogadro/fragments/amino_acids/D-isoleucine.cml
  782. share/avogadro/fragments/amino_acids/D-leucine.cml
  783. share/avogadro/fragments/amino_acids/D-lysine.cml
  784. share/avogadro/fragments/amino_acids/D-methionine.cml
  785. share/avogadro/fragments/amino_acids/D-phenylalanine.cml
  786. share/avogadro/fragments/amino_acids/D-proline.cml
  787. share/avogadro/fragments/amino_acids/D-serine.cml
  788. share/avogadro/fragments/amino_acids/D-threonine.cml
  789. share/avogadro/fragments/amino_acids/D-tryptophan.cml
  790. share/avogadro/fragments/amino_acids/D-tyrosine.cml
  791. share/avogadro/fragments/amino_acids/D-valine.cml
  792. share/avogadro/fragments/amino_acids/L-4-nitrophenylalanine.cml
  793. share/avogadro/fragments/amino_acids/L-alanine.cml
  794. share/avogadro/fragments/amino_acids/L-allo-isoleucine.cml
  795. share/avogadro/fragments/amino_acids/L-arginine.cml
  796. share/avogadro/fragments/amino_acids/L-asparagine.cml
  797. share/avogadro/fragments/amino_acids/L-aspartic_acid.cml
  798. share/avogadro/fragments/amino_acids/L-cysteine.cml
  799. share/avogadro/fragments/amino_acids/L-glutamic_acid.cml
  800. share/avogadro/fragments/amino_acids/L-glutamine.cml
  801. share/avogadro/fragments/amino_acids/L-histidine.cml
  802. share/avogadro/fragments/amino_acids/L-isoleucine.cml
  803. share/avogadro/fragments/amino_acids/L-leucine.cml
  804. share/avogadro/fragments/amino_acids/L-lysine.cml
  805. share/avogadro/fragments/amino_acids/L-methionine.cml
  806. share/avogadro/fragments/amino_acids/L-phenylalanine.cml
  807. share/avogadro/fragments/amino_acids/L-proline.cml
  808. share/avogadro/fragments/amino_acids/L-serine.cml
  809. share/avogadro/fragments/amino_acids/L-threonine.cml
  810. share/avogadro/fragments/amino_acids/L-tryptophan.cml
  811. share/avogadro/fragments/amino_acids/L-tyrosine.cml
  812. share/avogadro/fragments/amino_acids/L-valine.cml
  813. share/avogadro/fragments/amino_acids/glycine.cml
  814. share/avogadro/fragments/aromatics/1H-indene.cml
  815. share/avogadro/fragments/aromatics/1H-indole.cml
  816. share/avogadro/fragments/aromatics/1_10-phenanthroline.cml
  817. share/avogadro/fragments/aromatics/1_8-naphthyridine.cml
  818. share/avogadro/fragments/aromatics/2H-chromene.cml
  819. share/avogadro/fragments/aromatics/4H-chromene.cml
  820. share/avogadro/fragments/aromatics/7H-purine.cml
  821. share/avogadro/fragments/aromatics/9H-carbazole.cml
  822. share/avogadro/fragments/aromatics/9H-fluorene.cml
  823. share/avogadro/fragments/aromatics/9H-xanthene.cml
  824. share/avogadro/fragments/aromatics/acenaphthene.cml
  825. share/avogadro/fragments/aromatics/acenaphthenequinone.cml
  826. share/avogadro/fragments/aromatics/acenaphthylene.cml
  827. share/avogadro/fragments/aromatics/acridine.cml
  828. share/avogadro/fragments/aromatics/aniline.cml
  829. share/avogadro/fragments/aromatics/anisole.cml
  830. share/avogadro/fragments/aromatics/anthracene.cml
  831. share/avogadro/fragments/aromatics/benzaldehyde.cml
  832. share/avogadro/fragments/aromatics/benzene.cml
  833. share/avogadro/fragments/aromatics/benzofuran.cml
  834. share/avogadro/fragments/aromatics/benzoic_acid.cml
  835. share/avogadro/fragments/aromatics/benzothiophene.cml
  836. share/avogadro/fragments/aromatics/benzoyl_chloride.cml
  837. share/avogadro/fragments/aromatics/caffeine.cml
  838. share/avogadro/fragments/aromatics/chromone.cml
  839. share/avogadro/fragments/aromatics/cinnoline.cml
  840. share/avogadro/fragments/aromatics/coumarin.cml
  841. share/avogadro/fragments/aromatics/isoquinoline.cml
  842. share/avogadro/fragments/aromatics/naphthalene.cml
  843. share/avogadro/fragments/aromatics/nitrobenzene.cml
  844. share/avogadro/fragments/aromatics/phenanthrene.cml
  845. share/avogadro/fragments/aromatics/phenol.cml
  846. share/avogadro/fragments/aromatics/phthalimide.cml
  847. share/avogadro/fragments/aromatics/quinazoline.cml
  848. share/avogadro/fragments/aromatics/quinoline.cml
  849. share/avogadro/fragments/aromatics/tetralin.cml
  850. share/avogadro/fragments/aromatics/toluene.cml
  851. share/avogadro/fragments/aromatics/uric_acid.cml
  852. share/avogadro/fragments/carbamides/urea.cml
  853. share/avogadro/fragments/carbohydrates/d-allose.cml
  854. share/avogadro/fragments/carbohydrates/d-altrose.cml
  855. share/avogadro/fragments/carbohydrates/d-arabinose.cml
  856. share/avogadro/fragments/carbohydrates/d-erythrose.cml
  857. share/avogadro/fragments/carbohydrates/d-erythrulose.cml
  858. share/avogadro/fragments/carbohydrates/d-fructose.cml
  859. share/avogadro/fragments/carbohydrates/d-galactose.cml
  860. share/avogadro/fragments/carbohydrates/d-glucose.cml
  861. share/avogadro/fragments/carbohydrates/d-glyceraldehyde.cml
  862. share/avogadro/fragments/carbohydrates/d-gulose.cml
  863. share/avogadro/fragments/carbohydrates/d-idose.cml
  864. share/avogadro/fragments/carbohydrates/d-lyxose.cml
  865. share/avogadro/fragments/carbohydrates/d-mannose.cml
  866. share/avogadro/fragments/carbohydrates/d-psicose.cml
  867. share/avogadro/fragments/carbohydrates/d-ribose.cml
  868. share/avogadro/fragments/carbohydrates/d-ribulose.cml
  869. share/avogadro/fragments/carbohydrates/d-sorbose.cml
  870. share/avogadro/fragments/carbohydrates/d-tagatose.cml
  871. share/avogadro/fragments/carbohydrates/d-talose.cml
  872. share/avogadro/fragments/carbohydrates/d-threose.cml
  873. share/avogadro/fragments/carbohydrates/d-xylose.cml
  874. share/avogadro/fragments/carbohydrates/d-xylulose.cml
  875. share/avogadro/fragments/carbohydrates/dihydroxyacetone.cml
  876. share/avogadro/fragments/carboxylic_acids/2_2-dichloroacetic_acid.cml
  877. share/avogadro/fragments/carboxylic_acids/2_2_2-trichloroacetic_acid.cml
  878. share/avogadro/fragments/carboxylic_acids/2_2_2-trifluoroacetic_acid.cml
  879. share/avogadro/fragments/carboxylic_acids/D-lactic_acid.cml
  880. share/avogadro/fragments/carboxylic_acids/D-malic_acid.cml
  881. share/avogadro/fragments/carboxylic_acids/D-tartaric_acid.cml
  882. share/avogadro/fragments/carboxylic_acids/E-butanoic_acid.cml
  883. share/avogadro/fragments/carboxylic_acids/E-butenedioic_acid.cml
  884. share/avogadro/fragments/carboxylic_acids/L-ascorbic_acid.cml
  885. share/avogadro/fragments/carboxylic_acids/L-lactic_acid.cml
  886. share/avogadro/fragments/carboxylic_acids/L-malic_acid.cml
  887. share/avogadro/fragments/carboxylic_acids/L-tartaric_acid.cml
  888. share/avogadro/fragments/carboxylic_acids/acetic_acid.cml
  889. share/avogadro/fragments/carboxylic_acids/butanoic_acid.cml
  890. share/avogadro/fragments/carboxylic_acids/citric_acid.cml
  891. share/avogadro/fragments/carboxylic_acids/formic_acid.cml
  892. share/avogadro/fragments/carboxylic_acids/isobutyric_acid.cml
  893. share/avogadro/fragments/carboxylic_acids/oxalic_acid.cml
  894. share/avogadro/fragments/carboxylic_acids/propanoic_acid.cml
  895. share/avogadro/fragments/coordination/3-trigonal-planar.cml
  896. share/avogadro/fragments/coordination/3-trigonal-pyramidal.cml
  897. share/avogadro/fragments/coordination/4-planar.cml
  898. share/avogadro/fragments/coordination/4-tetrahedral.cml
  899. share/avogadro/fragments/coordination/5-square-pyramidal.cml
  900. share/avogadro/fragments/coordination/5-trigonal-bipyramidal.cml
  901. share/avogadro/fragments/coordination/6-octahedral.cml
  902. share/avogadro/fragments/cyclic_alkanes/1R-camphene.cml
  903. share/avogadro/fragments/cyclic_alkanes/1R-camphor.cml
  904. share/avogadro/fragments/cyclic_alkanes/abietic_acid.cml
  905. share/avogadro/fragments/cyclic_alkanes/adamantane.cml
  906. share/avogadro/fragments/cyclic_alkanes/cis-decahydronaphthalene.cml
  907. share/avogadro/fragments/cyclic_alkanes/cubane.cml
  908. share/avogadro/fragments/cyclic_alkanes/cyclobutane.cml
  909. share/avogadro/fragments/cyclic_alkanes/cyclodecane.cml
  910. share/avogadro/fragments/cyclic_alkanes/cycloheptane.cml
  911. share/avogadro/fragments/cyclic_alkanes/cyclohexane-chair.cml
  912. share/avogadro/fragments/cyclic_alkanes/cyclohexane-twist-boat.cml
  913. share/avogadro/fragments/cyclic_alkanes/cyclohexane.cml
  914. share/avogadro/fragments/cyclic_alkanes/cyclononane.cml
  915. share/avogadro/fragments/cyclic_alkanes/cyclooctane.cml
  916. share/avogadro/fragments/cyclic_alkanes/cyclopentane.cml
  917. share/avogadro/fragments/cyclic_alkanes/cyclopropane.cml
  918. share/avogadro/fragments/cyclic_alkanes/norbornane.cml
  919. share/avogadro/fragments/cyclic_alkanes/trans-decahydronaphthalene.cml
  920. share/avogadro/fragments/cyclic_alkenes/Z-cycloheptene.cml
  921. share/avogadro/fragments/cyclic_alkenes/Z-cyclooctene.cml
  922. share/avogadro/fragments/cyclic_alkenes/cyclohepta-1_3-diene.cml
  923. share/avogadro/fragments/cyclic_alkenes/cyclohepta-1_3_5-triene.cml
  924. share/avogadro/fragments/cyclic_alkenes/cyclohepta-1_4-diene.cml
  925. share/avogadro/fragments/cyclic_alkenes/cyclohexa-1_3-diene.cml
  926. share/avogadro/fragments/cyclic_alkenes/cyclohexa-1_4-diene.cml
  927. share/avogadro/fragments/cyclic_alkenes/cyclohexene.cml
  928. share/avogadro/fragments/cyclic_alkenes/cycloocta-1_3-diene.cml
  929. share/avogadro/fragments/cyclic_alkenes/cycloocta-1_3_5-triene.cml
  930. share/avogadro/fragments/cyclic_alkenes/cycloocta-1_3_5_7-tetraene.cml
  931. share/avogadro/fragments/cyclic_alkenes/cyclopenta-1_3-diene.cml
  932. share/avogadro/fragments/cyclic_alkenes/cyclopentene.cml
  933. share/avogadro/fragments/cyclic_sugars/alpha-D-allopyranose.cml
  934. share/avogadro/fragments/cyclic_sugars/alpha-D-arabinopyranose.cml
  935. share/avogadro/fragments/cyclic_sugars/alpha-D-fucopyranose.cml
  936. share/avogadro/fragments/cyclic_sugars/alpha-D-galactopyranose.cml
  937. share/avogadro/fragments/cyclic_sugars/alpha-D-galacturonopyranose.cml
  938. share/avogadro/fragments/cyclic_sugars/alpha-D-glucopyranose.cml
  939. share/avogadro/fragments/cyclic_sugars/alpha-D-glucuronopyranose.cml
  940. share/avogadro/fragments/cyclic_sugars/alpha-D-gulopyranose.cml
  941. share/avogadro/fragments/cyclic_sugars/alpha-D-idopyranose.cml
  942. share/avogadro/fragments/cyclic_sugars/alpha-D-lyxopyranose.cml
  943. share/avogadro/fragments/cyclic_sugars/alpha-D-mannopyranose.cml
  944. share/avogadro/fragments/cyclic_sugars/alpha-D-psicopyranose.cml
  945. share/avogadro/fragments/cyclic_sugars/alpha-D-rhamnopyranose.cml
  946. share/avogadro/fragments/cyclic_sugars/alpha-D-ribopyranose.cml
  947. share/avogadro/fragments/cyclic_sugars/alpha-D-tagatopyranose.cml
  948. share/avogadro/fragments/cyclic_sugars/alpha-D-talopyranose.cml
  949. share/avogadro/fragments/cyclic_sugars/alpha-D-xylopyranose.cml
  950. share/avogadro/fragments/cyclic_sugars/alpha-L-arabinopyranose.cml
  951. share/avogadro/fragments/cyclic_sugars/alpha-L-fucopyranose.cml
  952. share/avogadro/fragments/cyclic_sugars/alpha-L-galactopyranose.cml
  953. share/avogadro/fragments/cyclic_sugars/alpha-L-lyxopyranose.cml
  954. share/avogadro/fragments/cyclic_sugars/alpha-L-rhamnopyranose.cml
  955. share/avogadro/fragments/cyclic_sugars/alpha-L-ribopyranose.cml
  956. share/avogadro/fragments/cyclic_sugars/alpha-L-sorbopyranose.cml
  957. share/avogadro/fragments/cyclic_sugars/alpha-L-xylopyranose.cml
  958. share/avogadro/fragments/cyclic_sugars/beta-D-allopyranose.cml
  959. share/avogadro/fragments/cyclic_sugars/beta-D-arabinopyranose.cml
  960. share/avogadro/fragments/cyclic_sugars/beta-D-fructopyranose.cml
  961. share/avogadro/fragments/cyclic_sugars/beta-D-fucopyranose.cml
  962. share/avogadro/fragments/cyclic_sugars/beta-D-galactopyranose.cml
  963. share/avogadro/fragments/cyclic_sugars/beta-D-glucopyranose.cml
  964. share/avogadro/fragments/cyclic_sugars/beta-D-gulopyranose.cml
  965. share/avogadro/fragments/cyclic_sugars/beta-D-idopyranose.cml
  966. share/avogadro/fragments/cyclic_sugars/beta-D-lyxopyranose.cml
  967. share/avogadro/fragments/cyclic_sugars/beta-D-mannopyranose.cml
  968. share/avogadro/fragments/cyclic_sugars/beta-D-rhamnopyranose.cml
  969. share/avogadro/fragments/cyclic_sugars/beta-D-ribopyranose.cml
  970. share/avogadro/fragments/cyclic_sugars/beta-D-tagatopyranose.cml
  971. share/avogadro/fragments/cyclic_sugars/beta-D-talopyranose.cml
  972. share/avogadro/fragments/cyclic_sugars/beta-D-xylopyranose.cml
  973. share/avogadro/fragments/cyclic_sugars/beta-L-arabinopyranose.cml
  974. share/avogadro/fragments/cyclic_sugars/beta-L-lyxopyranose.cml
  975. share/avogadro/fragments/cyclic_sugars/beta-L-ribopyranose.cml
  976. share/avogadro/fragments/cyclic_sugars/beta-L-xylopyranose.cml
  977. share/avogadro/fragments/ethers/1_4-dioxane.cml
  978. share/avogadro/fragments/ethers/di-tert-butylether.cml
  979. share/avogadro/fragments/ethers/dibutylether.cml
  980. share/avogadro/fragments/ethers/diethylether.cml
  981. share/avogadro/fragments/ethers/diisopropylether.cml
  982. share/avogadro/fragments/ethers/dimethylether.cml
  983. share/avogadro/fragments/ethers/dipropylether.cml
  984. share/avogadro/fragments/ethers/ethylmethylether.cml
  985. share/avogadro/fragments/ethers/tetrahydrofuran.cml
  986. share/avogadro/fragments/ethers/tetrahydropyran.cml
  987. share/avogadro/fragments/fatty_acids/arachidonic_acid.cml
  988. share/avogadro/fragments/fatty_acids/cervonic_acid.cml
  989. share/avogadro/fragments/fatty_acids/decanoic_acid.cml
  990. share/avogadro/fragments/fatty_acids/hexanoic_acid.cml
  991. share/avogadro/fragments/fatty_acids/lauric_acid.cml
  992. share/avogadro/fragments/fatty_acids/linoleic_acid.cml
  993. share/avogadro/fragments/fatty_acids/linolenic_acid.cml
  994. share/avogadro/fragments/fatty_acids/myristic_acid.cml
  995. share/avogadro/fragments/fatty_acids/octanoic_acid.cml
  996. share/avogadro/fragments/fatty_acids/oleic_acid.cml
  997. share/avogadro/fragments/fatty_acids/palmitic_acid.cml
  998. share/avogadro/fragments/fatty_acids/pentanoic_acid.cml
  999. share/avogadro/fragments/fatty_acids/stearic_acid.cml
  1000. share/avogadro/fragments/fullerenes/C180.cml
  1001. share/avogadro/fragments/fullerenes/C20.cml
  1002. share/avogadro/fragments/fullerenes/C24.cml
  1003. share/avogadro/fragments/fullerenes/C240.cml
  1004. share/avogadro/fragments/fullerenes/C26.cml
  1005. share/avogadro/fragments/fullerenes/C28.cml
  1006. share/avogadro/fragments/fullerenes/C30.cml
  1007. share/avogadro/fragments/fullerenes/C32.cml
  1008. share/avogadro/fragments/fullerenes/C36.cml
  1009. share/avogadro/fragments/fullerenes/C50.cml
  1010. share/avogadro/fragments/fullerenes/C60-buckminsterfullerene.cml
  1011. share/avogadro/fragments/fullerenes/C70.cml
  1012. share/avogadro/fragments/fullerenes/C76.cml
  1013. share/avogadro/fragments/fullerenes/C78.cml
  1014. share/avogadro/fragments/fullerenes/C80.cml
  1015. share/avogadro/fragments/fullerenes/PC70BM.cml
  1016. share/avogadro/fragments/fullerenes/PCBM.cml
  1017. share/avogadro/fragments/heteroaromatics/1H-indole.cml
  1018. share/avogadro/fragments/heteroaromatics/1H-pyrazole.cml
  1019. share/avogadro/fragments/heteroaromatics/1H-pyrrole.cml
  1020. share/avogadro/fragments/heteroaromatics/1_2-oxazole.cml
  1021. share/avogadro/fragments/heteroaromatics/1_2-thiazole.cml
  1022. share/avogadro/fragments/heteroaromatics/1_3-oxazole.cml
  1023. share/avogadro/fragments/heteroaromatics/1_3-thiazole.cml
  1024. share/avogadro/fragments/heteroaromatics/benzofuran.cml
  1025. share/avogadro/fragments/heteroaromatics/benzothiophene.cml
  1026. share/avogadro/fragments/heteroaromatics/furan.cml
  1027. share/avogadro/fragments/heteroaromatics/isonicotinamide.cml
  1028. share/avogadro/fragments/heteroaromatics/isonicotinic_acid.cml
  1029. share/avogadro/fragments/heteroaromatics/nicotinamide.cml
  1030. share/avogadro/fragments/heteroaromatics/nicotinic_acid.cml
  1031. share/avogadro/fragments/heteroaromatics/picolinamide.cml
  1032. share/avogadro/fragments/heteroaromatics/picolinic_acid.cml
  1033. share/avogadro/fragments/heteroaromatics/pyridine.cml
  1034. share/avogadro/fragments/heteroaromatics/thiophene.cml
  1035. share/avogadro/fragments/ketones/acetone.cml
  1036. share/avogadro/fragments/ketones/butanone.cml
  1037. share/avogadro/fragments/ketones/cyclohexanone.cml
  1038. share/avogadro/fragments/ketones/methyl_vinyl_ketone.cml
  1039. share/avogadro/fragments/ketones/p-benzoquinone.cml
  1040. share/avogadro/fragments/ligands/Cp-cyclopentadienyl.cml
  1041. share/avogadro/fragments/macrocycles/phthalocyanine.cml
  1042. share/avogadro/fragments/macrocycles/porphin.cml
  1043. share/avogadro/fragments/nitriles/1_1_1-trichloroacetonitrile.cml
  1044. share/avogadro/fragments/nitriles/acetonitrile.cml
  1045. share/avogadro/fragments/nitriles/butyronitrile.cml
  1046. share/avogadro/fragments/nitriles/isobutyronitrile.cml
  1047. share/avogadro/fragments/nitriles/propionitrile.cml
  1048. share/avogadro/fragments/nucleobases/adenine.cml
  1049. share/avogadro/fragments/nucleobases/cytosine.cml
  1050. share/avogadro/fragments/nucleobases/guanine.cml
  1051. share/avogadro/fragments/nucleobases/thymine.cml
  1052. share/avogadro/fragments/nucleobases/uracil.cml
  1053. share/avogadro/fragments/steroids/cholesterol.cml
  1054. share/avogadro/fragments/steroids/estradiol.cml
  1055. share/avogadro/fragments/steroids/testosterone.cml
  1056. share/avogadro/fragments/sulfoxides/dimethyl_sulfoxide.cml
  1057. share/avogadro/fragments/thiols/2-methylproprane-2-thiol.cml
  1058. share/avogadro/fragments/thiols/R_butane-2-thiol.cml
  1059. share/avogadro/fragments/thiols/butane-1-thiol.cml
  1060. share/avogadro/fragments/thiols/ethane-1_2-dithiol.cml
  1061. share/avogadro/fragments/thiols/ethanethiol.cml
  1062. share/avogadro/fragments/thiols/heptane-1-thiol.cml
  1063. share/avogadro/fragments/thiols/hexane-1-thiol.cml
  1064. share/avogadro/fragments/thiols/methanethiol.cml
  1065. share/avogadro/fragments/thiols/octane-1-thiol.cml
  1066. share/avogadro/fragments/thiols/pentane-1-thiol.cml
  1067. share/avogadro/fragments/thiols/proprane-1-thiol.cml
  1068. share/avogadro/fragments/thiols/proprane-2-thiol.cml
  1069. share/avogadro/fragments/water.cml
  1070. share/avogadro/i18n/avogadro_af.qm
  1071. share/avogadro/i18n/avogadro_ar.qm
  1072. share/avogadro/i18n/avogadro_bg.qm
  1073. share/avogadro/i18n/avogadro_ca.qm
  1074. share/avogadro/i18n/avogadro_ca@valencia.qm
  1075. share/avogadro/i18n/avogadro_cs.qm
  1076. share/avogadro/i18n/avogadro_da.qm
  1077. share/avogadro/i18n/avogadro_de.qm
  1078. share/avogadro/i18n/avogadro_el.qm
  1079. share/avogadro/i18n/avogadro_en_AU.qm
  1080. share/avogadro/i18n/avogadro_en_CA.qm
  1081. share/avogadro/i18n/avogadro_en_GB.qm
  1082. share/avogadro/i18n/avogadro_es.qm
  1083. share/avogadro/i18n/avogadro_et.qm
  1084. share/avogadro/i18n/avogadro_eu.qm
  1085. share/avogadro/i18n/avogadro_fi.qm
  1086. share/avogadro/i18n/avogadro_fr.qm
  1087. share/avogadro/i18n/avogadro_fr_CA.qm
  1088. share/avogadro/i18n/avogadro_gl.qm
  1089. share/avogadro/i18n/avogadro_he.qm
  1090. share/avogadro/i18n/avogadro_hi.qm
  1091. share/avogadro/i18n/avogadro_hr.qm
  1092. share/avogadro/i18n/avogadro_hu.qm
  1093. share/avogadro/i18n/avogadro_id.qm
  1094. share/avogadro/i18n/avogadro_it.qm
  1095. share/avogadro/i18n/avogadro_ja.qm
  1096. share/avogadro/i18n/avogadro_kn.qm
  1097. share/avogadro/i18n/avogadro_ko.qm
  1098. share/avogadro/i18n/avogadro_ms.qm
  1099. share/avogadro/i18n/avogadro_nb.qm
  1100. share/avogadro/i18n/avogadro_nl.qm
  1101. share/avogadro/i18n/avogadro_oc.qm
  1102. share/avogadro/i18n/avogadro_pl.qm
  1103. share/avogadro/i18n/avogadro_pt.qm
  1104. share/avogadro/i18n/avogadro_pt_BR.qm
  1105. share/avogadro/i18n/avogadro_ru.qm
  1106. share/avogadro/i18n/avogadro_sk.qm
  1107. share/avogadro/i18n/avogadro_sl.qm
  1108. share/avogadro/i18n/avogadro_sq.qm
  1109. share/avogadro/i18n/avogadro_sr.qm
  1110. share/avogadro/i18n/avogadro_sv.qm
  1111. share/avogadro/i18n/avogadro_ta.qm
  1112. share/avogadro/i18n/avogadro_te.qm
  1113. share/avogadro/i18n/avogadro_th.qm
  1114. share/avogadro/i18n/avogadro_tr.qm
  1115. share/avogadro/i18n/avogadro_ug.qm
  1116. share/avogadro/i18n/avogadro_uk.qm
  1117. share/avogadro/i18n/avogadro_vi.qm
  1118. share/avogadro/i18n/avogadro_zh_CN.qm
  1119. share/avogadro/i18n/avogadro_zh_TW.qm
  1120. share/avogadro/i18n/libavogadro_ar.qm
  1121. share/avogadro/i18n/libavogadro_bg.qm
  1122. share/avogadro/i18n/libavogadro_bs.qm
  1123. share/avogadro/i18n/libavogadro_ca.qm
  1124. share/avogadro/i18n/libavogadro_ca@valencia.qm
  1125. share/avogadro/i18n/libavogadro_cs.qm
  1126. share/avogadro/i18n/libavogadro_da.qm
  1127. share/avogadro/i18n/libavogadro_de.qm
  1128. share/avogadro/i18n/libavogadro_el.qm
  1129. share/avogadro/i18n/libavogadro_en_AU.qm
  1130. share/avogadro/i18n/libavogadro_en_CA.qm
  1131. share/avogadro/i18n/libavogadro_en_GB.qm
  1132. share/avogadro/i18n/libavogadro_es.qm
  1133. share/avogadro/i18n/libavogadro_et.qm
  1134. share/avogadro/i18n/libavogadro_eu.qm
  1135. share/avogadro/i18n/libavogadro_fi.qm
  1136. share/avogadro/i18n/libavogadro_fr.qm
  1137. share/avogadro/i18n/libavogadro_gl.qm
  1138. share/avogadro/i18n/libavogadro_he.qm
  1139. share/avogadro/i18n/libavogadro_hi.qm
  1140. share/avogadro/i18n/libavogadro_hu.qm
  1141. share/avogadro/i18n/libavogadro_id.qm
  1142. share/avogadro/i18n/libavogadro_it.qm
  1143. share/avogadro/i18n/libavogadro_ja.qm
  1144. share/avogadro/i18n/libavogadro_kn.qm
  1145. share/avogadro/i18n/libavogadro_ko.qm
  1146. share/avogadro/i18n/libavogadro_ms.qm
  1147. share/avogadro/i18n/libavogadro_nb.qm
  1148. share/avogadro/i18n/libavogadro_nl.qm
  1149. share/avogadro/i18n/libavogadro_oc.qm
  1150. share/avogadro/i18n/libavogadro_pl.qm
  1151. share/avogadro/i18n/libavogadro_pt.qm
  1152. share/avogadro/i18n/libavogadro_pt_BR.qm
  1153. share/avogadro/i18n/libavogadro_ru.qm
  1154. share/avogadro/i18n/libavogadro_sk.qm
  1155. share/avogadro/i18n/libavogadro_sl.qm
  1156. share/avogadro/i18n/libavogadro_sq.qm
  1157. share/avogadro/i18n/libavogadro_sr.qm
  1158. share/avogadro/i18n/libavogadro_sv.qm
  1159. share/avogadro/i18n/libavogadro_th.qm
  1160. share/avogadro/i18n/libavogadro_tr.qm
  1161. share/avogadro/i18n/libavogadro_ug.qm
  1162. share/avogadro/i18n/libavogadro_uk.qm
  1163. share/avogadro/i18n/libavogadro_vi.qm
  1164. share/avogadro/i18n/libavogadro_zh_CN.qm
  1165. share/avogadro/i18n/libavogadro_zh_TW.qm
  1166. share/libavogadro/engineScripts/wireframe.py
  1167. share/libavogadro/extensionScripts/example.py
  1168. share/pixmaps/avogadro-icon.png
  1169. share/qt4/mkspecs/features/avogadro.prf
  1170. @postexec /usr/sbin/service ldconfig restart > /dev/null
  1171. @postunexec /usr/sbin/service ldconfig restart > /dev/null
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Dependency lines:
  • avogadro>0:science/avogadro
Conflicts:
CONFLICTS_INSTALL:
  • libmsym
Conflicts Matches:
There are no Conflicts Matches for this port. This is usually an error.
No installation instructions:
This port has been deleted.
PKGNAME: avogadro
Flavors: there is no flavor information for this port.
distinfo:
TIMESTAMP = 1539715101 SHA256 (avogadro-1.2.0.tar.gz) = 6453e36e8ae3e61655cbe062df6d6fa6b2409122c7b5abc0a6f1d410a181640b SIZE (avogadro-1.2.0.tar.gz) = 16779635

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Dependencies
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies:
  1. py27-numpy>0 : math/py-numpy@py27
  2. py27-sip>0 : devel/py-sip@py27
  3. cmake : devel/cmake
  4. ninja : devel/ninja
  5. update-desktop-database : devel/desktop-file-utils
  6. eigen2.pc : math/eigen2
  7. pkgconf>=1.3.0_1 : devel/pkgconf
  8. python2.7 : lang/python27
  9. xorgproto>=0 : x11/xorgproto
  10. xorgproto>=0 : x11/xorgproto
  11. x11.pc : x11/libX11
  12. lrelease : devel/qt4-linguisttools
  13. moc : devel/qt4-moc
  14. qmake : devel/qt4-qmake
  15. rcc : devel/qt4-rcc
  16. uic : devel/qt4-uic
Runtime dependencies:
  1. py27-numpy>0 : math/py-numpy@py27
  2. py27-sip>0 : devel/py-sip@py27
  3. update-desktop-database : devel/desktop-file-utils
  4. eigen2.pc : math/eigen2
  5. python2.7 : lang/python27
  6. x11.pc : x11/libX11
Library dependencies:
  1. libopenbabel.so : science/openbabel
  2. libboost_python27.so : devel/boost-python-libs@py27
  3. libGLU.so : graphics/libGLU
  4. libGL.so : graphics/mesa-libs
  5. libQtCore.so : devel/qt4-corelib
  6. libQtGui.so : x11-toolkits/qt4-gui
  7. libQtNetwork.so : net/qt4-network
  8. libQtOpenGL.so : graphics/qt4-opengl
NOTE: dependencies for deleted ports are notoriously suspect
This port is required by:
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Deleted ports which required this port:

Expand this list of 1 deleted port
  1. science/kalzium-kde4*
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* - deleted ports are only shown under the This port is required by section. It was harder to do for the Required section. Perhaps later...

Configuration Options:
===> The following configuration options are available for avogadro-1.2.0_2: PYTHON=on: Python bindings or support ===> Use 'make config' to modify these settings
Options name:
N/A
USES:
cmake desktop-file-utils eigen:2,build,run gl pkgconfig qt:4 python:2.7
FreshPorts was unable to extract/find any pkg message
Master Sites:
Expand this list (26 items)
Collapse this list.
  1. http://cytranet.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  2. http://downloads.sourceforge.net/project/avogadro/avogadro/1.2.0/
  3. http://excellmedia.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  4. http://freefr.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  5. http://jaist.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  6. http://kent.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  7. http://nchc.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  8. http://netcologne.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  9. http://netix.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  10. http://superb-dca2.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  11. http://superb-sea2.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  12. http://ufpr.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  13. http://vorboss.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  14. https://cytranet.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  15. https://downloads.sourceforge.net/project/avogadro/avogadro/1.2.0/
  16. https://excellmedia.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  17. https://freefr.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  18. https://jaist.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  19. https://kent.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  20. https://nchc.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  21. https://netcologne.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  22. https://netix.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  23. https://superb-dca2.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  24. https://superb-sea2.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  25. https://ufpr.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
  26. https://vorboss.dl.sourceforge.net/project/avogadro/avogadro/1.2.0/
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There are no commits on branch 2022Q2 for this port