From 3cd136861c68b8c24cc653c903c620d55be4b294 Mon Sep 17 00:00:00 2001
From: Andreas Maunz <andreas@maunz.de>
Date: Mon, 2 Apr 2012 09:18:14 +0200
Subject: Remove PC descriptor

---
 java/resources/smartsEvaluation/lanthanides.mol | 48 -------------------------
 1 file changed, 48 deletions(-)
 delete mode 100644 java/resources/smartsEvaluation/lanthanides.mol

(limited to 'java/resources/smartsEvaluation/lanthanides.mol')

diff --git a/java/resources/smartsEvaluation/lanthanides.mol b/java/resources/smartsEvaluation/lanthanides.mol
deleted file mode 100644
index 3d7984a..0000000
--- a/java/resources/smartsEvaluation/lanthanides.mol
+++ /dev/null
@@ -1,48 +0,0 @@
-lanthanides
-  -ISIS-            2D
-Used JOELib chemistry kernel (expert systems) ID is 715333816
- 18 24  0  0  0  0  0  0  0  0  2 V2000
-    3.5847   -3.5847    0.0000 La  0  0  0  0  0  0  0  0  0  0  0  0
-    3.2933   -5.3833    0.0000 Tb  0  0  0  0  0  0  0  0  0  0  0  0
-    5.6873   -3.5847    0.0000 Ce  0  0  0  0  0  0  0  0  0  0  0  0
-    5.6873   -5.3833    0.0000 Dy  0  0  0  0  0  0  0  0  0  0  0  0
-    8.0813   -3.5847    0.0000 Pr  0  0  0  0  0  0  0  0  0  0  0  0
-    7.7773   -5.3833    0.0000 Ho  0  0  0  0  0  0  0  0  0  0  0  0
-   10.1713   -3.5847    0.0000 Nd  0  0  0  0  0  0  0  0  0  0  0  0
-   10.1713   -5.3833    0.0000 Er  0  0  0  0  0  0  0  0  0  0  0  0
-   12.5653   -3.5847    0.0000 Pm  0  0  0  0  0  0  0  0  0  0  0  0
-   12.5653   -5.3833    0.0000 Tm  0  0  0  0  0  0  0  0  0  0  0  0
-   14.9593   -3.2933    0.0000 Sm  0  5  0  0  0  0  0  0  0  0  0  0
-   15.5547   -5.3833    0.0000 Yb  0  5  0  0  0  0  0  0  0  0  0  0
-   17.0493   -2.9893    0.0000 Eu  0  5  0  0  0  0  0  0  0  0  0  0
-   18.2527   -5.0920    0.0000 Lu  0  0  0  0  0  0  0  0  0  0  0  0
-   19.4433   -2.9893    0.0000 Gd  0  0  0  0  0  0  0  0  0  0  0  0
-    2.6980   -2.3940    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
-    2.0900   -5.9787    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
-   21.2420   -2.3940    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
-  1  2  1  0  0  0  0
-  1  3  1  0  0  0  0
-  2  4  1  0  0  0  0
-  3  4  1  0  0  0  0
-  3  5  1  0  0  0  0
-  5  6  1  0  0  0  0
-  4  6  1  0  0  0  0
-  5  7  1  0  0  0  0
-  7  8  1  0  0  0  0
-  6  8  1  0  0  0  0
-  7  9  1  0  0  0  0
-  9 10  1  0  0  0  0
-  8 10  1  0  0  0  0
-  9 11  1  0  0  0  0
- 11 12  1  0  0  0  0
- 10 12  1  0  0  0  0
- 11 13  1  0  0  0  0
- 13 14  1  0  0  0  0
- 12 14  1  0  0  0  0
- 13 15  1  0  0  0  0
- 15 14  1  0  0  0  0
- 16  1  1  0  0  0  0
- 17  2  1  0  0  0  0
- 18 15  1  0  0  0  0
-M  CHG  3  11  -1  12  -1  13  -1
-M  END
-- 
cgit v1.2.3