ATOM 27
1 C1y C 20.0732 -16.6997
2 C1y C 19.6581 -18.0092
3 C1b C 21.3711 -16.2671
4 O2x O 18.9743 -15.9046
5 C1y C 18.2844 -18.0092
6 O1a O 20.4650 -19.1140
7 O2b O 22.3883 -17.1791
8 C1y C 17.8575 -16.6997
9 O1a O 17.4776 -19.1140
10 P1b P 23.7620 -17.1732
11 O2c O 25.1300 -17.1732
12 O1c O 23.7620 -18.5471
13 O1c O 23.7620 -15.8112
14 P1b P 26.4980 -17.1732
15 O2b O 27.8717 -17.1791
16 O1c O 26.4980 -18.5471
17 O1c O 26.4980 -15.8112
18 C1b C 28.8889 -16.2671
19 C1y C 30.1868 -16.6997
20 C1y C 30.6019 -18.0092
21 O2x O 31.2857 -15.9046
22 C1y C 31.9756 -18.0092
23 O1a O 29.7950 -19.1140
24 C1y C 32.4025 -16.6997
25 O1a O 32.7824 -19.1140
26 R R 33.7295 -16.2622
27 R R 16.5305 -16.2622
BOND 28
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 2 5 1
5 2 6 1 #Up
6 3 7 1
7 4 8 1
8 5 9 1 #Up
9 7 10 1
10 10 11 1
11 10 12 1
12 10 13 2
13 11 14 1
14 14 15 1
15 14 16 1
16 14 17 2
17 15 18 1
18 19 18 1 #Up
19 19 20 1
20 19 21 1
21 20 22 1
22 20 23 1 #Down
23 21 24 1
24 22 25 1 #Down
25 5 8 1
26 22 24 1
27 24 26 1 #Up
28 8 27 1 #Down
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