ATOM 19
1 N1y N 31.1759 -18.8251
2 C1y C 31.1700 -20.2288
3 C5x C 29.9653 -18.1175
4 C1x C 32.5094 -18.3923
5 C5x C 29.9536 -20.9189
6 C1x C 32.5094 -20.6674
7 C1y C 28.7487 -18.8134
8 O5x O 29.9536 -16.7138
9 C1x C 33.3341 -19.5327
10 N1x N 28.7429 -20.2112
11 O5x O 29.9359 -22.3109
12 C1b C 27.5439 -18.1116
13 C8y C 26.3390 -18.8076
14 C8x C 26.3390 -20.2054
15 C8x C 25.1285 -18.1058
16 C8x C 25.1285 -20.9072
17 C8x C 23.9178 -18.8076
18 C8y C 23.9178 -20.2054
19 O1a O 22.7012 -20.8955
BOND 21
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 1
9 5 10 1
10 5 11 2
11 7 12 1 #Up
12 12 13 1
13 13 14 2
14 13 15 1
15 14 16 1
16 15 17 2
17 16 18 2
18 18 19 1
19 6 9 1
20 7 10 1
21 17 18 1
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