ATOM 19
1 C1b C 28.6717 -21.7485
2 C1b C 29.8884 -22.4429
3 C1b C 27.4490 -22.4429
4 C2b C 31.0989 -21.7485
5 C1b C 26.2385 -21.7485
6 C2b C 32.3157 -22.4429
7 C1b C 25.0219 -22.4429
8 C1b C 33.5262 -21.7485
9 C1b C 23.8114 -21.7485
10 C1b C 34.7490 -22.4429
11 C1b C 22.5887 -22.4429
12 C1b C 35.9595 -21.7485
13 C6a C 21.3780 -21.7485
14 C1b C 37.1762 -22.4429
15 O6a O 20.1614 -22.4490
16 C1b C 38.3866 -21.7485
17 C1b C 39.6095 -22.4429
18 C1a C 40.8200 -21.7485
19 O6a O 21.3768 -20.3459
BOND 18
1 1 2 1
2 1 3 1
3 2 4 1
4 3 5 1
5 4 6 2
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 16 17 1
17 17 18 1
18 13 19 2
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