annotate test-data/o_molblock.mol @ 0:2f59c6239f25 draft default tip

"planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
author bgruening
date Sat, 10 Oct 2020 09:43:40 +0000
parents
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
rev   line source
0
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
1
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
2 Mrv1810 07121910172D
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
3
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
4 4 3 0 0 0 0 999 V2000
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
5 -2.5038 0.4060 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
6 -2.5038 1.2310 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
7 -3.2182 -0.0065 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
8 -1.7893 -0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
9 1 2 1 0 0 0 0
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
10 1 3 1 0 0 0 0
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
11 1 4 1 4 0 0 0
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
12 M CHG 2 2 -1 3 1
2f59c6239f25 "planemo upload for repository https://github.com/chembl/chembl_webresource_client commit 78f2261af4e00c830ea311337d0aed9b297aad8e-dirty"
bgruening
parents:
diff changeset
13 M END