ALIGN 1
1 1:O0 10:O1a #R1
- * 4:C1y #D1
ENTRY1
COMPOUND
C00001
ATOM 1
1 O0 O 22.1250 -16.2017
BOND 0
ENTRY2
COMPOUND
C15568
ATOM 29
1 C1y C 25.1905 -21.5792
2 C1y C 26.3773 -20.8985
3 C1y C 24.0095 -20.8926
4 C1y C 25.1730 -22.9523
5 C1z C 26.3949 -19.5545
6 C1x C 28.7105 -20.9276
7 C1z C 22.8108 -21.5618
8 C1x C 24.0268 -19.5254
9 C1x C 23.9918 -23.6331
10 O1a O 26.3600 -23.8073
11 C1y C 27.5701 -18.8971
12 C1y C 25.2079 -18.8273
13 C1a C 26.4112 -18.4030
14 C1x C 28.7221 -19.5837
15 C2y C 22.8050 -22.9174
16 C1x C 21.6413 -20.8810
17 C1a C 22.8341 -20.1887
18 C1c C 27.5876 -17.5356
19 O1a O 25.1437 -17.9527
20 C2x C 21.6180 -23.6039
21 C1x C 20.4428 -21.5502
22 C1b C 28.7744 -16.8664
23 C1a C 26.6912 -16.0688
24 C5x C 20.4253 -22.9350
25 C1b C 29.9498 -17.5647
26 C6a C 31.1426 -16.9014
27 O6a O 32.3121 -17.5995
28 O6a O 31.0845 -15.6736
29 O5x O 19.2132 -23.6346
BOND 32
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 4 10 1 #Down
10 5 11 1
11 5 12 1
12 5 13 1 #Up
13 6 14 1
14 7 15 1
15 7 16 1
16 7 17 1 #Up
17 11 18 1
18 12 19 1 #Down
19 15 20 2
20 16 21 1
21 18 22 1
22 18 23 1 #Down
23 20 24 1
24 22 25 1
25 25 26 1
26 26 27 1
27 26 28 2
28 8 12 1
29 9 15 1
30 11 14 1
31 21 24 1
32 24 29 2
