ALIGN 1
1 1:O0 9:O6a #R1
- * 4:C6a #D1
ENTRY1
COMPOUND
C00001
ATOM 1
1 O0 O 22.1250 -16.2017
BOND 0
ENTRY2
COMPOUND
C01839
ATOM 12
1 C8y C 22.1200 -15.0908
2 C8y C 20.9095 -15.7888
3 C8y C 23.3370 -15.7888
4 C6a C 22.1137 -13.7009
5 C8x C 20.9095 -17.1979
6 C1a C 19.7053 -15.0908
7 C8x C 23.3370 -17.1979
8 O1a O 24.5475 -15.0908
9 O6a O 23.3177 -12.9963
10 O6a O 20.9030 -13.0026
11 C8y C 22.1200 -17.9090
12 O1a O 22.1137 -19.3752
BOND 12
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 2
10 5 11 2
11 11 12 1
12 7 11 1