ATOM 27
1 C8x C 17.7100 -40.7400
2 C8x C 17.7100 -42.1400
3 C8x C 18.9224 -42.8400
4 C8y C 20.1349 -42.1400
5 C8y C 20.1349 -40.7400
6 C8x C 18.9224 -40.0400
7 N1y N 21.3473 -42.8400
8 C1y C 22.5597 -42.1400
9 C1z C 22.5597 -40.7400
10 C1y C 23.7722 -42.8400
11 N1y N 24.9846 -42.1400
12 C1y C 24.9846 -40.7400
13 C1x C 23.7722 -40.0400
14 C1x C 23.7722 -44.2400
15 C1y C 24.9846 -44.9400
16 C1y C 26.1970 -44.2400
17 C1y C 26.1970 -42.8400
18 C1a C 21.3473 -44.2400
19 O1a O 27.3966 -42.1473
20 C1b C 27.3966 -44.9327
21 C1a C 28.5859 -44.2460
22 C1y C 26.8170 -38.4777
23 C1y C 22.9097 -38.0800
24 O7a O 22.0337 -36.9724
25 C7a C 21.0438 -35.9825
26 C1a C 19.7166 -36.3381
27 O6a O 21.4082 -34.6215
BOND 32
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 5 1 #Down
11 8 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 9 13 1
16 10 14 1
17 14 15 1
18 15 16 1
19 16 17 1
20 11 17 1
21 7 18 1
22 17 19 1 #Down
23 16 20 1 #Up
24 20 21 1
25 15 22 1 #Up
26 12 22 1 #Up
27 9 23 1
28 22 23 1
29 23 24 1 #Down
30 24 25 1
31 25 26 1
32 25 27 2
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