diff options
author | Andreas Maunz <andreas@maunz.de> | 2012-04-02 09:18:14 +0200 |
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committer | Andreas Maunz <andreas@maunz.de> | 2012-04-02 09:18:14 +0200 |
commit | 3cd136861c68b8c24cc653c903c620d55be4b294 (patch) | |
tree | ab50372c9ed9cab413e72b62f219d23ca481e935 /java/resources/smartsEvaluation/alkali_elements.mol | |
parent | cb67fe0e722a58b6fcf212ef045808dc9a13053a (diff) |
Remove PC descriptor
Diffstat (limited to 'java/resources/smartsEvaluation/alkali_elements.mol')
-rw-r--r-- | java/resources/smartsEvaluation/alkali_elements.mol | 17 |
1 files changed, 0 insertions, 17 deletions
diff --git a/java/resources/smartsEvaluation/alkali_elements.mol b/java/resources/smartsEvaluation/alkali_elements.mol deleted file mode 100644 index ea0c7ea..0000000 --- a/java/resources/smartsEvaluation/alkali_elements.mol +++ /dev/null @@ -1,17 +0,0 @@ -alkali_elements
- -ISIS- 2D
-Used JOELib chemistry kernel (expert systems) ID is 715333816
- 6 5 0 0 0 0 0 0 0 0 2 V2000
- 4.7880 -3.8887 0.0000 Li 0 0 0 0 0 0 0 0 0 0 0 0
- 6.5867 -3.5847 0.0000 Na 0 5 0 0 0 0 0 0 0 0 0 0
- 8.9807 -3.5847 0.0000 K 0 5 0 0 0 0 0 0 0 0 0 0
- 11.9700 -3.5847 0.0000 Rb 0 5 0 0 0 0 0 0 0 0 0 0
- 14.9593 -3.8887 0.0000 Cs 0 5 0 0 0 0 0 0 0 0 0 0
- 17.0493 -3.8887 0.0000 Fr 0 0 0 0 0 0 0 0 0 0 0 0
- 1 2 1 0 0 0 0
- 2 3 1 0 0 0 0
- 3 4 1 0 0 0 0
- 4 5 1 0 0 0 0
- 5 6 1 0 0 0 0
-M CHG 4 2 -1 3 -1 4 -1 5 -1
-M END
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