ATOM 21
1 C2y C 28.0949 -19.3092
2 C1z C 28.0949 -20.7017
3 C2y C 26.8857 -18.6192
4 C2b C 29.2847 -18.6130
5 C1x C 26.8857 -21.4044
6 C1a C 28.6278 -22.2991
7 C1a C 29.4113 -21.0499
8 C1x C 25.6957 -19.3092
9 C1a C 26.8793 -17.2394
10 C2b C 30.4812 -19.3029
11 C1x C 25.6957 -20.7017
12 C2c C 31.6710 -18.6065
13 C2b C 32.8611 -19.2966
14 C1a C 31.6648 -17.2332
15 C2b C 32.8613 -20.7097
16 C2b C 34.0649 -21.4118
17 C2c C 34.0586 -22.8051
18 C2b C 35.2622 -23.5072
19 C1b C 35.2561 -24.9005
20 O1a O 36.4402 -25.5912
21 C1a C 32.8461 -23.4980
BOND 21
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 2
10 5 11 1
11 10 12 1
12 12 13 2
13 12 14 1
14 8 11 1
15 13 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 1
21 17 21 1
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