ATOM 23
1 C1x C 38.9736 -18.2180
2 C1y C 38.9736 -19.5857
3 C1x C 40.1580 -20.2695
4 C1y C 41.3425 -19.5857
5 C1z C 41.3425 -18.2180
6 C1x C 40.1580 -17.5341
7 C1x C 42.5270 -20.2695
8 C1x C 43.7114 -19.5857
9 C1y C 43.7114 -18.2180
10 C1y C 42.5270 -17.5341
11 C1y C 44.8959 -17.5341
12 C1z C 44.8959 -16.1664
13 C1x C 43.7114 -15.4825
14 C1x C 42.5270 -16.1664
15 C1x C 47.2648 -17.5341
16 C1x C 47.2648 -16.1664
17 C1y C 46.0804 -15.4825
18 C1c C 46.0804 -14.1148
19 C1a C 47.2688 -13.4287
20 O1a O 44.8999 -13.4332
21 C1a C 44.8959 -14.7987
22 C1a C 41.3425 -16.8502
23 O1a O 37.7891 -20.2695
BOND 26
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 17 18 1
22 18 19 1
23 18 20 1 #Up
24 12 21 1 #Up
25 5 22 1 #Up
26 2 23 1 #Down
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