mirror of
https://github.com/rdkit/rdkit.git
synced 2026-06-07 22:44:25 +08:00
15 lines
523 B
Plaintext
15 lines
523 B
Plaintext
|
|
Mrv0541 07091305252D
|
|
|
|
5 4 0 0 1 0 999 V2000
|
|
0.1473 2.4455 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
|
|
0.8618 2.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
|
|
-0.5671 2.8580 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
|
|
0.1473 1.6205 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
|
|
-0.5671 2.0330 0.0000 Cl 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
|
|
1 4 1 0 0 0 0
|
|
1 5 1 1 0 0 0
|
|
M END
|