Marvin 11171010252D 7 5 0 0 0 0 999 V2000 -1.5321 0.5304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7071 0.5304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1238 1.1137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1155 1.1137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1155 -0.0530 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1238 -0.0530 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1491 -0.5598 0.0000 Ca 0 2 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 2 6 1 0 0 0 0 M CHG 3 5 -1 6 -1 7 2 M END