From 5c802c69d36459c4fad4f0979b1aab972a0c3261 Mon Sep 17 00:00:00 2001
From: Kick-H <30561696+Kick-H@users.noreply.github.com>
Date: Sun, 3 Jan 2021 09:38:38 +0800
Subject: [PATCH] Update data.py

Pizza always cannot recognize the data file with the line 'Atoms # full'.
Here I add a split with the line to compare with the 'skewords'.
---
 src/data.py | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/src/data.py b/src/data.py
index 2932eee..68c20d2 100644
--- a/src/data.py
+++ b/src/data.py
@@ -127,7 +127,7 @@ def __init__(self,*list):
       found = 0
       for pair in skeywords:
         keyword,length = pair[0],pair[1]
-        if keyword == line:
+        if keyword == line.split('#')[0].strip():
 	  found = 1
           if not headers.has_key(length):
             raise StandardError, \