ATOM 21
1 C1z C 25.7502 -19.8217
2 C1z C 25.7560 -18.4116
3 C1z C 24.4217 -20.2470
4 C1x C 26.9797 -20.5209
5 O2x O 26.4960 -21.2379
6 C1x C 24.4217 -17.9862
7 C1x C 26.9797 -17.7182
8 C1a C 25.7443 -17.0074
9 O2x O 23.6059 -19.1225
10 C2x C 24.4158 -21.6398
11 C1a C 23.0582 -20.6083
12 C1y C 28.1859 -19.8160
13 C2x C 25.7385 -22.0826
14 C1x C 28.1859 -18.4116
15 C1d C 29.3920 -20.5093
16 O7a O 30.6040 -19.8100
17 C1a C 29.4084 -21.9898
18 C1a C 29.3861 -19.1108
19 C7a C 31.8161 -20.5035
20 C1a C 33.0280 -19.7984
21 O6a O 31.8161 -21.9078
BOND 23
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 2 8 1 #Up
8 3 9 1
9 3 10 1
10 3 11 1 #Down
11 4 12 1
12 5 13 1
13 7 14 1
14 12 15 1
15 15 16 1
16 15 17 1
17 15 18 1
18 16 19 1
19 19 20 1
20 19 21 2
21 6 9 1
22 10 13 2
23 12 14 1
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