ATOM 38
1 C1y C 28.7299 -18.9963
2 C1y C 27.3439 -18.9963
3 O2x O 28.0367 -17.7810
4 C1b C 30.2292 -18.9379
5 C1b C 26.1510 -19.6895
6 C1b C 31.4333 -18.3147
7 C1b C 24.8105 -19.7007
8 C1b C 32.6378 -19.0079
9 C2b C 23.6063 -19.0079
10 C1b C 33.8419 -18.3147
11 C2b C 22.2088 -19.0079
12 C1b C 35.0461 -19.0079
13 C1b C 21.0047 -19.7007
14 C1b C 36.2390 -18.3147
15 C1b C 19.8121 -19.0079
16 C1b C 37.4431 -19.0079
17 C1b C 18.6076 -19.7007
18 C1b C 38.6473 -18.3147
19 C1b C 17.4035 -19.0079
20 C1b C 39.8514 -19.0079
21 C1b C 16.1994 -19.7007
22 C1b C 41.0555 -18.3147
23 C1b C 14.9952 -19.0079
24 C1b C 42.2484 -19.0079
25 C1b C 13.8023 -19.7007
26 C1b C 43.4526 -18.3147
27 C1b C 12.5982 -19.0079
28 C2y C 44.6567 -19.0079
29 C1b C 11.3941 -19.7007
30 C2x C 45.7814 -18.1899
31 C7x C 45.0886 -20.3257
32 C1b C 10.1899 -19.0079
33 C1y C 46.9062 -19.0079
34 O7x O 46.4746 -20.3257
35 O6a O 44.2706 -21.4501
36 C1b C 8.9970 -19.7007
37 C1a C 48.2240 -18.5760
38 C1a C 7.7813 -19.0079
BOND 39
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 4 6 1
6 5 7 1
7 6 8 1
8 7 9 1
9 8 10 1
10 9 11 2
11 10 12 1
12 11 13 1
13 12 14 1
14 13 15 1
15 14 16 1
16 15 17 1
17 16 18 1
18 17 19 1
19 18 20 1
20 19 21 1
21 20 22 1
22 21 23 1
23 22 24 1
24 23 25 1
25 24 26 1
26 25 27 1
27 26 28 1
28 27 29 1
29 28 30 2
30 28 31 1
31 29 32 1
32 30 33 1
33 31 34 1
34 31 35 2
35 32 36 1
36 33 37 1
37 36 38 1
38 2 3 1
39 33 34 1
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