ATOM 20
1 C1y C 21.2985 -20.6723
2 C1z C 20.0751 -19.9673
3 O2x O 20.0868 -21.3771
4 C1b C 22.4985 -19.9673
5 C1b C 18.8577 -20.6607
6 C1a C 20.0694 -18.5635
7 C1b C 23.7103 -20.6607
8 C2c C 24.9219 -19.9616
9 C2b C 26.1337 -20.6547
10 C1a C 24.9161 -18.5576
11 C1b C 27.3394 -19.9499
12 C1b C 28.5511 -20.6490
13 C2c C 29.7628 -19.9440
14 C2b C 30.9686 -20.6431
15 C1a C 29.7628 -18.5459
16 C7a C 32.1804 -19.9383
17 O7a O 32.1687 -18.5402
18 O6a O 33.3863 -20.6373
19 C1a C 33.3804 -17.8354
20 O1a O 17.6242 -19.9386
BOND 20
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 1
6 4 7 1
7 7 8 1
8 8 9 2
9 8 10 1
10 9 11 1
11 11 12 1
12 12 13 1
13 13 14 2
14 13 15 1
15 14 16 1
16 16 17 1
17 16 18 2
18 17 19 1
19 2 3 1 #Up
20 5 20 1
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