ATOM 29
1 C1z C 26.6896 -15.9841
2 C1y C 25.4674 -15.2706
3 C1z C 27.9236 -15.2883
4 C1y C 26.6837 -17.3993
5 C1x C 26.0873 -14.9665
6 C1z C 24.2335 -15.9724
7 C1y C 25.4734 -13.8554
8 C1z C 27.9353 -13.8730
9 C1y C 29.1458 -16.0017
10 O1a O 28.0519 -16.7033
11 C1x C 25.4500 -18.1127
12 O7x O 27.9059 -18.1185
13 O2x O 26.8009 -14.1003
14 C1y C 24.2277 -17.3933
15 C1y C 23.0055 -15.2648
16 C1a C 24.2218 -14.5514
17 C1y C 26.7130 -13.1536
18 O1a O 24.3969 -12.6402
19 C1a C 29.1575 -13.1536
20 C7x C 29.1341 -17.4227
21 O1a O 30.3855 -15.3057
22 C2y C 23.0055 -18.1068
23 C5x C 21.7716 -15.9724
24 O1a O 22.9938 -13.8437
25 O1a O 26.7247 -11.7327
26 O6a O 30.3621 -18.1478
27 C2x C 21.7716 -17.3933
28 C1a C 23.0113 -19.5279
29 O5x O 20.5436 -15.2648
BOND 33
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 3 10 1 #Up
10 4 11 1
11 4 12 1
12 5 13 1
13 6 14 1
14 6 15 1
15 6 16 1 #Up
16 7 17 1
17 7 18 1 #Up
18 8 19 1
19 9 20 1
20 9 21 1 #Up
21 14 22 1
22 15 23 1
23 15 24 1 #Up
24 17 25 1 #Down
25 20 26 2
26 22 27 2
27 22 28 1
28 23 29 2
29 8 13 1 #Up
30 8 17 1
31 11 14 1
32 12 20 1
33 23 27 1
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