ATOM 20
1 C2y C 24.1905 -17.1795
2 C2y C 25.7203 -17.1212
3 C1x C 25.0022 -18.4580
4 C1b C 22.9819 -16.4906
5 C1b C 26.9289 -16.5022
6 C1b C 21.7850 -17.1853
7 C1b C 28.1198 -17.1912
8 C1b C 20.5940 -16.4906
9 C1b C 29.3110 -16.5022
10 C1b C 19.4030 -17.1853
11 C1b C 30.5079 -17.1912
12 C1b C 18.2061 -16.4906
13 C1b C 31.7048 -16.5022
14 C1b C 17.0150 -17.1853
15 C1b C 32.8958 -17.1912
16 C6a C 15.8181 -16.4906
17 C1b C 34.0869 -16.5022
18 O6a O 14.6095 -17.1853
19 O6a O 15.8181 -15.1127
20 C1a C 35.2955 -17.1912
BOND 20
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 4 6 1
6 5 7 1
7 6 8 1
8 7 9 1
9 8 10 1
10 9 11 1
11 10 12 1
12 11 13 1
13 12 14 1
14 13 15 1
15 14 16 1
16 15 17 1
17 16 18 1
18 16 19 2
19 17 20 1
20 2 3 1
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