ALIGN 1
1 4:N1a 3:N1a #R1
- 1:C1c * #D1
- * 1:C1c #D1
ENTRY1
COMPOUND
C00025
ATOM 10
1 C1c C 23.8372 -17.4608
2 C1b C 25.0252 -16.7233
3 C6a C 22.6023 -16.7994
4 N1a N 23.8781 -18.8595
5 C1b C 26.2601 -17.3788
6 O6a O 21.4434 -17.5954
7 O6a O 22.6198 -15.4007
8 C6a C 27.4482 -16.6414
9 O6a O 28.6830 -17.3028
10 O6a O 27.4714 -15.2426
BOND 9
1 1 2 1
2 1 3 1
3 1 4 1 #Down
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
C01021
ATOM 7
1 C1c C 26.5594 -21.7056
2 C6a C 27.7664 -21.0001
3 N1a N 26.5594 -23.1050
4 C1b C 25.3407 -21.0061
5 O6a O 28.9734 -21.6939
6 O6a O 27.7606 -19.5950
7 R R 24.1283 -21.7061
BOND 6
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 2
6 4 7 1