ATOM 21
1 C1y C 25.1977 -12.7823
2 C1y C 23.7820 -12.8071
3 C1z C 26.0886 -13.8590
4 O2x O 26.5748 -12.5439
5 C1y C 22.9328 -13.9402
6 O2x O 22.3764 -12.6417
7 C1x C 25.8080 -15.2410
8 C1a C 27.5033 -13.8529
9 C2y C 23.2818 -15.3002
10 C1y C 26.7998 -16.2185
11 C2x C 24.5631 -15.8862
12 C7x C 22.5757 -16.5166
13 C1y C 26.1767 -17.4733
14 O7x O 28.1934 -16.4295
15 C1y C 24.7958 -17.2648
16 O7x O 23.4431 -17.6177
17 O6a O 21.1725 -16.5407
18 C2y C 27.1770 -18.4605
19 C7x C 28.4276 -17.8136
20 C2a C 26.9716 -19.8525
21 O6a O 29.6882 -18.4355
BOND 25
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 1 #Down
8 5 9 1
9 7 10 1
10 9 11 2
11 9 12 1
12 10 13 1
13 10 14 1
14 11 15 1
15 12 16 1
16 12 17 2
17 13 18 1
18 14 19 1
19 18 20 2
20 19 21 2
21 3 4 1
22 5 6 1
23 13 15 1
24 15 16 1
25 18 19 1
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