ATOM 22
1 C8x C 23.4566 -16.2021
2 C8x C 23.4577 -17.5958
3 C8x C 24.6629 -15.5043
4 C8x C 24.6652 -18.2918
5 C8y C 25.8705 -16.2001
6 C8y C 25.8717 -17.5938
7 C7a C 27.0769 -15.5024
8 C7a C 27.0792 -18.2897
9 O7a O 28.2844 -16.1983
10 O7a O 28.2855 -17.5919
11 C1b C 29.4803 -15.5062
12 C1b C 30.6984 -16.2083
13 C1b C 29.4617 -18.2694
14 C1b C 30.6550 -17.5789
15 O6a O 27.0758 -14.0840
16 O6a O 27.0801 -19.8678
17 C1b C 31.9293 -15.4960
18 C1b C 31.8561 -18.2703
19 C1b C 33.0724 -17.5662
20 C1b C 33.1426 -16.1951
21 C1a C 34.3239 -15.5116
22 C1a C 34.2547 -18.2470
BOND 22
1 1 2 2
2 1 3 1
3 2 4 1
4 3 5 2
5 4 6 2
6 5 6 1
7 5 7 1
8 6 8 1
9 7 9 1
10 8 10 1
11 9 11 1
12 11 12 1
13 10 13 1
14 13 14 1
15 7 15 2
16 8 16 2
17 12 17 1
18 14 18 1
19 18 19 1
20 17 20 1
21 20 21 1
22 19 22 1
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