Files
rdkit/Code/GraphMol/FileParsers/test_data/chiral2.mol
Greg Landrum 75a79b6327 initial import
2006-05-06 22:20:08 +00:00

15 lines
523 B
Plaintext
Executable File

chiral2.mol
ChemDraw04200416412D
5 4 0 0 0 0 0 0 0 0999 V2000
-0.0141 0.0553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8109 0.0553 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
-0.4266 0.7697 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
-0.0141 -0.7697 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-0.8109 -0.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
1 3 1 0
1 4 1 6
1 5 1 0
M END