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/pyridine.mol | 17 ----------------- 1 file changed, 17 deletions(-) delete mode 100644 java/resources/smartsEvaluation/pyridine.mol (limited to 'java/resources/smartsEvaluation/pyridine.mol') diff --git a/java/resources/smartsEvaluation/pyridine.mol b/java/resources/smartsEvaluation/pyridine.mol deleted file mode 100644 index 203b9c9..0000000 --- a/java/resources/smartsEvaluation/pyridine.mol +++ /dev/null @@ -1,17 +0,0 @@ -pyridine - -ISIS- 2D -Used JOELib chemistry kernel (expert systems) ID is 715333816 - 6 6 0 0 0 0 0 0 0 0 1 V2000 - 7.4860 -5.9787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 7.1820 -8.6767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 9.5760 -4.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 11.3747 -6.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 11.3747 -8.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 - 8.9807 -10.4753 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 - 2 1 1 0 0 0 0 - 3 1 2 0 0 0 0 - 4 3 1 0 0 0 0 - 5 4 2 0 0 0 0 - 6 2 2 0 0 0 0 - 6 5 1 0 0 0 0 -M END -- cgit v1.2.3