ATOM 29
1 C1z C 28.2976 -16.1582
2 C1z C 27.0958 -16.8292
3 C1x C 29.4642 -16.8582
4 O7x O 29.4059 -15.3591
5 C1x C 27.1950 -15.3533
6 C1y C 27.0784 -18.2059
7 C1x C 25.9176 -16.1408
8 C1a C 26.4017 -15.4290
9 C1x C 29.4468 -18.2292
10 C7x C 28.9917 -14.0524
11 C1x C 27.6209 -14.0466
12 C1y C 25.8942 -18.8825
13 C1x C 24.7217 -16.8175
14 O6a O 29.8026 -12.9499
15 C1y C 24.7100 -18.1883
16 C1y C 25.8942 -20.2533
17 C1z C 23.5199 -18.8709
18 C1x C 24.6983 -20.9417
19 S2a S 27.0784 -20.9476
20 C2y C 23.5142 -20.2417
21 C1x C 22.3300 -18.1825
22 C1a C 23.5082 -17.4942
23 C5a C 28.2683 -20.2593
24 C2x C 22.3300 -20.9359
25 C1x C 21.1398 -18.8709
26 C1a C 29.4525 -20.9476
27 O5a O 28.2743 -18.8825
28 C5x C 21.1398 -20.2417
29 O5x O 19.9499 -20.9359
BOND 33
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 1 5 1 #Down
5 2 6 1
6 2 7 1
7 2 8 1 #Up
8 3 9 1
9 4 10 1
10 5 11 1
11 6 12 1
12 7 13 1
13 10 14 2
14 12 15 1
15 12 16 1
16 15 17 1
17 16 18 1
18 16 19 1 #Down
19 17 20 1
20 17 21 1
21 17 22 1 #Up
22 19 23 1
23 20 24 2
24 21 25 1
25 23 26 1
26 23 27 2
27 24 28 1
28 28 29 2
29 6 9 1
30 10 11 1
31 13 15 1
32 18 20 1
33 25 28 1
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