ALIGN 1
1 4:O5a 12:O4a #R1
- 1:C5a * #D1
- * 11: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
C01250
ATOM 12
1 C1c C 20.8851 -15.8225
2 N1b N 19.6685 -16.5175
3 C6a C 20.8851 -14.4195
4 C1b C 22.0949 -16.5175
5 C5a C 19.6685 -17.9205
6 O6a O 22.0949 -13.7179
7 O6a O 19.6685 -13.7179
8 C1b C 23.3115 -15.8225
9 C1a C 20.8151 -18.5521
10 O5a O 18.4587 -18.6221
11 C4a C 24.5213 -16.5175
12 O4a O 25.6613 -15.8925
BOND 11
1 1 2 1 #Down
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 1
6 3 7 2
7 4 8 1
8 5 9 1
9 5 10 2
10 8 11 1
11 11 12 2
