ATOM 21
1 C1y C 27.0497 -17.1378
2 C1y C 26.6512 -18.4079
3 N4y N 27.9710 -15.2577
4 O2x O 25.9351 -16.3286
5 C1y C 25.2752 -18.4079
6 O2b O 27.4418 -19.4974
7 C8y C 26.8005 -14.5666
8 C8x C 29.1601 -14.5666
9 C1y C 24.8394 -17.1192
10 O1a O 24.4907 -19.5098
11 P1b P 28.7929 -19.4974
12 N5x N 26.8005 -13.1969
13 O5x O 25.6239 -15.2390
14 C8x C 29.1601 -13.1969
15 C1b C 23.5694 -16.7207
16 O1c O 30.1376 -19.5551
17 O1c O 28.7804 -17.9161
18 O1c O 28.7929 -20.8484
19 C8y C 27.9710 -12.5183
20 O1a O 22.7475 -17.7916
21 N1a N 28.0349 -11.1672
BOND 22
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1 #Down
10 6 11 1
11 7 12 1
12 7 13 2
13 8 14 2
14 9 15 1 #Up
15 11 16 1
16 11 17 1
17 11 18 2
18 12 19 2
19 15 20 1
20 19 21 1
21 5 9 1
22 14 19 1
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