ATOM 21
1 C2y C 28.2844 -19.8579
2 N1x N 27.9203 -21.2051
3 C5x C 29.0894 -21.9726
4 C1z C 30.1786 -21.0951
5 N2x N 29.6084 -19.8599
6 C8x C 24.6542 -17.7566
7 C8y C 24.6542 -19.1596
8 C8x C 25.8660 -19.8576
9 C8y C 27.0778 -19.1596
10 C8y C 27.0778 -17.7566
11 C8x C 25.8660 -17.0516
12 C7a C 28.2849 -17.0587
13 O7a O 29.4976 -17.7638
14 O6a O 28.2780 -15.6557
15 C1a C 30.7102 -17.0516
16 C1c C 31.3799 -21.7963
17 C1a C 32.5925 -21.0912
18 C1a C 31.3728 -23.1993
19 C1a C 31.1613 -20.0202
20 O5x O 29.1517 -23.3754
21 C1a C 23.4347 -19.8505
BOND 22
1 3 20 2
2 9 10 1
3 7 21 1
4 10 11 2
5 11 6 1
6 10 12 1
7 1 2 1
8 12 13 1
9 2 3 1
10 12 14 2
11 3 4 1
12 13 15 1
13 9 1 1
14 4 5 1
15 4 16 1
16 5 1 2
17 16 17 1
18 6 7 2
19 16 18 1
20 7 8 1
21 4 19 1
22 8 9 2
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