From 748fe9b8e6e2e786d69f7fed7cc1e88942fb89e8 Mon Sep 17 00:00:00 2001
From: Jintao <jintaowu@campus.technion.ac.il>
Date: Fri, 11 Oct 2024 08:00:44 +0800
Subject: [PATCH] WELL_GAP

---
 arc/species/conformers.py | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/arc/species/conformers.py b/arc/species/conformers.py
index b465358f9f..982d63cecf 100644
--- a/arc/species/conformers.py
+++ b/arc/species/conformers.py
@@ -91,7 +91,7 @@
 DE_THRESHOLD = 5.
 
 # The gap (in degrees) that defines different wells
-WELL_GAP = 20
+WELL_GAP = 31
 
 # The maximum number of times to iteratively search for the lowest conformer
 MAX_COMBINATION_ITERATIONS = 25