ATOM 29
1 C8y C 28.1047 -18.2932
2 C8y C 28.0404 -16.8879
3 C5x C 29.2475 -18.9989
4 C8x C 26.8276 -18.9930
5 C5x C 29.2592 -16.1939
6 C8y C 26.8276 -16.1881
7 C8y C 30.4604 -18.2991
8 O5x O 29.2418 -20.4042
9 C8y C 25.6088 -18.2932
10 C8y C 30.4721 -16.8996
11 O5x O 29.2649 -14.7945
12 C8x C 25.6088 -16.8879
13 O1a O 26.8333 -14.7886
14 C8x C 31.6617 -19.0106
15 O2a O 24.3958 -18.9930
16 C8y C 31.6908 -16.2115
17 C8y C 32.8746 -18.3165
18 C1y C 23.1829 -18.2875
19 C8x C 32.8863 -16.9229
20 O1a O 31.7025 -14.8119
21 C1a C 34.0817 -19.0339
22 O2x O 23.0394 -16.8761
23 C1x C 21.6528 -16.5765
24 C1z C 20.9393 -17.8027
25 C1y C 21.8850 -18.8601
26 O1a O 21.5971 -20.1946
27 O1a O 19.9494 -18.7926
28 C1b C 19.8132 -16.9358
29 O1a O 18.5147 -17.4712
BOND 32
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 5 10 1
10 5 11 2
11 6 12 2
12 6 13 1
13 7 14 1
14 9 15 1
15 10 16 1
16 14 17 2
17 18 15 1 #Up
18 16 19 2
19 16 20 1
20 17 21 1
21 7 10 2
22 9 12 1
23 17 19 1
24 18 22 1
25 22 23 1
26 23 24 1
27 24 25 1
28 18 25 1
29 25 26 1 #Down
30 24 27 1 #Down
31 24 28 1 #Up
32 28 29 1
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