Skip to content

Instantly share code, notes, and snippets.

@tbereau
Created April 19, 2013 07:31
Show Gist options
  • Save tbereau/5418709 to your computer and use it in GitHub Desktop.
Save tbereau/5418709 to your computer and use it in GitHub Desktop.
Acetone PDB
ATOM 1 C1 LIG O 1 -1.572 -1.974 -1.412 1.00 0.00 O1
ATOM 2 C2 LIG O 1 -0.873 -1.710 -0.085 1.00 0.00 O1
ATOM 3 O1 LIG O 1 0.006 -0.848 0.086 1.00 0.00 O1
ATOM 4 C3 LIG O 1 -1.406 -2.648 0.972 1.00 0.00 O1
ATOM 5 H1 LIG O 1 -1.800 -3.000 -1.522 1.00 0.00 O1
ATOM 6 H2 LIG O 1 -2.474 -1.426 -1.590 1.00 0.00 O1
ATOM 7 H3 LIG O 1 -0.905 -1.801 -2.305 1.00 0.00 O1
ATOM 8 H4 LIG O 1 -2.463 -2.735 1.032 1.00 0.00 O1
ATOM 9 H5 LIG O 1 -1.069 -3.613 0.608 1.00 0.00 O1
ATOM 10 H6 LIG O 1 -1.093 -2.515 1.991 1.00 0.00 O1
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment