ALIGN 1
1 4:O5a 33:O5x #R1
- 1:C5a * #D1
- * 31:C5x #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
C18032
ATOM 33
1 C1y C 38.2900 -25.7600
2 N4y N 39.6200 -25.2700
3 O2x O 37.1700 -24.9200
4 C1x C 37.8700 -27.0900
5 C8y C 40.6700 -26.2500
6 C8x C 39.9000 -23.9400
7 C1y C 36.0500 -25.7600
8 C1y C 36.4700 -27.0900
9 N4x N 42.0700 -25.7600
10 O5x O 40.3900 -27.5800
11 C8y C 41.2300 -23.4500
12 C1b C 34.7900 -25.3400
13 O1a O 35.7000 -28.2100
14 C8y C 42.3500 -24.4300
15 C1a C 41.5100 -22.0500
16 O2b O 33.7400 -26.2500
17 O5x O 43.6800 -23.9400
18 P1b P 32.3400 -26.2500
19 O2c O 30.9400 -26.2500
20 O1c O 32.3400 -27.6500
21 O1c O 32.3400 -24.8500
22 P1b P 29.5400 -26.2500
23 O2b O 28.1400 -26.2500
24 O1c O 29.5400 -27.6500
25 O1c O 29.5400 -24.8500
26 C1y C 26.9500 -26.9500
27 C1x C 26.9500 -28.3500
28 O2x O 25.7600 -26.2500
29 C1x C 25.6900 -29.0500
30 C1y C 24.5000 -26.9500
31 C5x C 24.5000 -28.3500
32 C1a C 23.3100 -26.2500
33 O5x O 23.3100 -28.9800
BOND 35
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 2
10 6 11 2
11 7 12 1 #Up
12 8 13 1 #Down
13 9 14 1
14 11 15 1
15 12 16 1
16 14 17 2
17 16 18 1
18 18 19 1
19 18 20 1
20 18 21 2
21 19 22 1
22 22 23 1
23 22 24 1
24 22 25 2
25 26 23 1 #Down
26 26 27 1
27 26 28 1
28 27 29 1
29 28 30 1
30 29 31 1
31 30 32 1 #Up
32 31 33 2
33 7 8 1
34 11 14 1
35 30 31 1
