ALIGN 1
1 4:O5a 7:O4a #R1
- 1:C5a * #D1
- * 6:C4a #D1
ENTRY1
COMPOUND
C00026
ATOM 10
1 C5a C 23.3536 -16.5190
2 C1b C 22.1378 -15.8177
3 C6a C 24.5630 -15.8177
4 O5a O 23.3536 -17.9913
5 C1b C 20.9284 -16.5190
6 O6a O 25.7725 -16.5253
7 O6a O 24.5565 -14.4217
8 C6a C 19.7126 -15.8177
9 O6a O 19.7189 -14.4217
10 O6a O 18.5031 -16.5253
BOND 9
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 3 6 1
6 3 7 2
7 5 8 1
8 8 9 1
9 8 10 2
ENTRY2
COMPOUND
C00232
ATOM 7
1 C1b C 0.1000 -0.1759
2 C6a C 0.8172 0.2414
3 C1b C -0.6172 0.2345
4 O6a O 1.5379 -0.1759
5 O6a O 0.8172 1.0655
6 C4a C -1.3310 -0.1793
7 O4a O -1.3276 -1.0035
BOND 6
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 2
5 3 6 1
6 6 7 2