ALIGN 15
1 1:C8y 1:C8y
2 2:C8y 2:C8y
3 3:N4x 3:N4x
4 4:C8y 4:C8y
5 5:C8x 5:C8x
6 6:C8y 6:C8y
7 7:O5x 7:O5x
8 8:C6a 8:C6a
9 9:O6a 9:O6a
10 10:O6a 10:O6a
11 11:O1a 11:O1a
12 12:C1b 12:C1b
13 13:C1b 13:C1b #M1
14 14:C4a 14:C6a #R1
15 15:O4a 16:O6a #M1
- * 15:O6a #D1
ENTRY1
COMPOUND
C05654
ATOM 15
1 C8y C 26.5665 -20.3344
2 C8y C 26.5665 -21.7006
3 N4x N 27.7496 -22.3836
4 C8y C 28.9327 -21.7006
5 C8x C 28.9327 -20.3344
6 C8y C 27.7496 -19.6513
7 O5x O 25.3835 -22.3836
8 C6a C 30.1158 -22.3836
9 O6a O 30.1158 -23.7497
10 O6a O 31.2988 -21.7006
11 O1a O 27.7496 -18.2852
12 C1b C 25.3835 -19.6513
13 C1b C 24.2003 -20.3344
14 C4a C 22.9878 -19.6344
15 O4a O 21.7754 -20.3344
BOND 15
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 2 7 2
8 4 8 1
9 8 9 2
10 8 10 1
11 6 11 1
12 1 12 1
13 12 13 1
14 13 14 1
15 14 15 2
ENTRY2
COMPOUND
C05655
ATOM 16
1 C8y C 26.5665 -20.3344
2 C8y C 26.5665 -21.7006
3 N4x N 27.7496 -22.3836
4 C8y C 28.9327 -21.7006
5 C8x C 28.9327 -20.3344
6 C8y C 27.7496 -19.6513
7 O5x O 25.3835 -22.3836
8 C6a C 30.1158 -22.3836
9 O6a O 30.1158 -23.7497
10 O6a O 31.2988 -21.7006
11 O1a O 27.7496 -18.2852
12 C1b C 25.3835 -19.6513
13 C1b C 24.2003 -20.3344
14 C6a C 22.9878 -19.6344
15 O6a O 21.7754 -20.3344
16 O6a O 22.9878 -18.2344
BOND 16
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 2 7 2
8 4 8 1
9 8 9 2
10 8 10 1
11 6 11 1
12 1 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 14 16 2
