File: macrocycle-8-ortho-hash.sdf.expected.cxsmi

package info (click to toggle)
rdkit 202503.1-5
  • links: PTS, VCS
  • area: main
  • in suites: forky, sid
  • size: 220,160 kB
  • sloc: cpp: 399,240; python: 77,453; ansic: 25,517; java: 8,173; javascript: 4,005; sql: 2,389; yacc: 1,565; lex: 1,263; cs: 1,081; makefile: 580; xml: 229; fortran: 183; sh: 105
file content (1 line) | stat: -rw-r--r-- 462 bytes parent folder | download | duplicates (2) 
1
 
C12=C(C=CC=C1F)CCCCCCCCC1=C2C=C(F)C=C1Cl |(0.70951,-0.242001,;0.70951,0.57727,;1.41902,0.986906,;2.12853,0.57727,;2.12853,-0.242001,;1.41902,-0.651636,;1.41902,-1.47091,;0,0.986906,;0.212043,1.77826,;-0.197593,2.48777,;-0.988947,2.69981,;-1.69846,2.29018,;-1.9105,1.49882,;-1.50086,0.789313,;-0.70951,0.57727,;-0.70951,-0.242001,;0,-0.651636,;0,-1.47091,;-0.70951,-1.88054,;-0.70951,-2.69981,;-1.41902,-1.47091,;-1.41902,-0.651636,;-2.12853,-0.242001,),wD:16.18|