From b9929e6e935d2d87d0092f3b1f1136a1fc9d93fe Mon Sep 17 00:00:00 2001
From: "Jan H. Jensen" <jhjensen@chem.ku.dk>
Date: Thu, 11 May 2023 09:13:01 +0200
Subject: [PATCH] Update README.md

Note on RDKit implementation
---
 README.md | 2 ++
 1 file changed, 2 insertions(+)

diff --git a/README.md b/README.md
index 58b3d68..965e0ad 100644
--- a/README.md
+++ b/README.md
@@ -1,8 +1,10 @@
 # xyz2mol has now been implented in RDKit
 
+```
 raw_mol = Chem.MolFromXYZFile('acetate.xyz')
 mol = Chem.Mol(raw_mol)
 rdDetermineBonds.DetermineBonds(mol,charge=-1)
+```
 
 # Convert Cartesian coordinates to one or more molecular graphs