From 3cd136861c68b8c24cc653c903c620d55be4b294 Mon Sep 17 00:00:00 2001 From: Andreas Maunz Date: Mon, 2 Apr 2012 09:18:14 +0200 Subject: Remove PC descriptor --- java/resources/smartsEvaluation/butan.mol | 12 ------------ 1 file changed, 12 deletions(-) delete mode 100644 java/resources/smartsEvaluation/butan.mol (limited to 'java/resources/smartsEvaluation/butan.mol') diff --git a/java/resources/smartsEvaluation/butan.mol b/java/resources/smartsEvaluation/butan.mol deleted file mode 100644 index e881f05..0000000 --- a/java/resources/smartsEvaluation/butan.mol +++ /dev/null @@ -1,12 +0,0 @@ -butan - -ISIS- 2D -Used JOELib chemistry kernel (expert systems) ID is 715333816 - 4 3 0 0 0 0 0 0 0 0 1 V2000 - 5.1807 -5.5480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 7.4100 -4.2813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 9.0693 -6.1813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 10.8047 -4.7120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 2 1 1 0 0 0 0 - 3 2 1 0 0 0 0 - 4 3 1 0 0 0 0 -M END -- cgit v1.2.3