ATOM 27
1 C8x C 27.5800 -24.7800
2 C8y C 27.5800 -26.1800
3 C8x C 28.7924 -26.8800
4 C8y C 30.0049 -26.1800
5 C8y C 30.0049 -24.7800
6 C8x C 28.7924 -24.0800
7 N2x N 31.2173 -26.8800
8 C2y C 32.4297 -26.1800
9 C1z C 32.4297 -24.7800
10 C1y C 33.6422 -26.8800
11 N1y N 34.8546 -26.1800
12 C1y C 34.8546 -24.7800
13 C1x C 33.6422 -24.0800
14 C1x C 33.6422 -28.2800
15 C1y C 34.8546 -28.9800
16 C2y C 36.0670 -28.2800
17 C1x C 36.0670 -26.8800
18 C2b C 37.2795 -28.9800
19 C1a C 37.2795 -30.3800
20 C1y C 36.0670 -24.0800
21 C1y C 33.5371 -23.0901
22 O7a O 33.5371 -21.6901
23 C7a C 32.3247 -20.9901
24 O6a O 31.1122 -21.6901
25 C1a C 32.3247 -19.5901
26 O2a O 26.3676 -26.8800
27 C1a C 25.1551 -26.1800
BOND 32
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 2
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 16 18 2
22 18 19 1
23 12 20 1 #Up
24 15 20 1 #Up
25 20 21 1
26 9 21 1
27 21 22 1 #Down
28 22 23 1
29 23 24 2
30 23 25 1
31 2 26 1
32 26 27 1
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