From 6f27bce9e64d9d851b81a183ca6f47596ff0ae4f Mon Sep 17 00:00:00 2001
From: Greg Landrum <greg.landrum@gmail.com>
Date: Tue, 4 Aug 2015 10:07:59 +0200
Subject: [PATCH] update another PAINS

---
 Data/Pains/wehi_pains.csv | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/Data/Pains/wehi_pains.csv b/Data/Pains/wehi_pains.csv
index ba28c7841..ee1db72f5 100644
--- a/Data/Pains/wehi_pains.csv
+++ b/Data/Pains/wehi_pains.csv
@@ -355,7 +355,7 @@
 "o:1:c(:c:c:2:c:1:c(:c(:c(:c:2-[#1])-[#8]-[#6](-[#1])-[#1])-[#8]-[#6](-[#1])-[#1])-[#1])-[#6](~[#8])~[#8]","<regId=het_65_J(1)>"
 "[#6]#[#6]-[#6](=[#8])-[#6]#[#6]","<regId=ene_one_yne_A(1)>"
 "c:2(:c:1:c(:c(:c(:c(:c:1:c(:c(:c:2-[#8]-[#1])-[#6]=[#8])-[#1])-[#1])-[#1])-[#1])-[#1])-[#7](-[#1])-[#1]","<regId=anil_OH_no_alk_B(1)>"
-"c:1(:c(:c(:c(:o:1)-[#1,$([#6](-[#1])-[#1])])-[#1])-[#1])-[#6](=[#8])-[#7](-[#1])-[#7]=[#6](-[#1,$([#6](-[#1])-[#1])])-c:2:c:c:c:c(:c:2)-[*]-[*]-[*]-c:3:c:c:c:o:3","<regId=hzone_acyl_misc_A(1)>"
+"c:1(:c(:c(:[c;!H0,$(c-[#6;!H0;!H1])](:o:1))-[#1])-[#1])-[#6](=[#8])-[#7](-[#1])-[#7]=[#6;!H0,$([#6]-[#6;!H0!H1])]-c:2:c:c:c:c(:c:2)-[*]-[*]-[*]-c:3:c:c:c:o:3","<regId=hzone_acyl_misc_A(1)>"
 "[#16](=[#8])(=[#8])-[#7](-[#1])-c:1:c(:c(:c(:s:1)-[#6]-[#1])-[#6]-[#1])-[#6](=[#8])-[#7]-[#1]","<regId=thiophene_F(1)>"
 "[#6](-[#1])(-[#1])-[#8]-c:1:c(:c(:c(:c(:c:1-[#1])-[#1])-[#1])-[#1])-[#7](-[#1])-[#6](-[#1])(-[#1])-[#6](-[#1])(-[#8]-[#1])-[#6](-[#1])-[#1]","<regId=anil_OC_alk_E(1)>"
 "[#6](-[#1])(-[#1])-[#8]-c:1:c(:c(:c(:c(:c:1-[#1])-[#1])-[#1])-[#1])-[#7](-[#1])-[#6](-[#1])(-[#6]=[#8])-[#16]","<regId=anil_OC_alk_F(1)>"