ATOM 27
1 C8y C 32.4126 -22.3043
2 C8y C 32.4067 -23.7143
3 C8y C 33.6246 -21.6168
4 N5x N 31.0782 -21.8672
5 N4x N 31.0725 -24.1455
6 N5x N 33.6246 -24.4135
7 N5x N 34.8366 -22.3101
8 N1b N 33.6246 -20.2183
9 C8x C 30.2566 -23.0093
10 C8x C 34.8366 -23.7143
11 C1b C 32.4126 -19.5131
12 C2b C 32.4126 -18.1149
13 C2c C 31.2065 -17.4156
14 C1b C 29.9946 -18.1149
15 C1a C 31.2065 -16.0172
16 O2a O 28.7767 -17.4156
17 C1y C 27.5589 -18.1089
18 O2x O 26.3527 -17.4156
19 C1y C 27.5589 -19.5131
20 C1y C 25.1349 -18.1089
21 C1y C 26.3527 -20.2124
22 O1a O 28.7767 -20.2124
23 C1y C 25.1349 -19.5131
24 C1b C 23.9287 -17.4097
25 O1a O 26.3527 -21.6109
26 O1a O 23.9230 -20.2124
27 O1a O 22.7226 -18.0973
BOND 29
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 2
9 6 10 2
10 8 11 1
11 11 12 1
12 12 13 2
13 13 14 1
14 13 15 1
15 14 16 1
16 17 16 1 #Up
17 17 18 1
18 17 19 1
19 18 20 1
20 19 21 1
21 19 22 1 #Down
22 20 23 1
23 20 24 1 #Up
24 21 25 1 #Up
25 23 26 1 #Down
26 24 27 1
27 5 9 1
28 7 10 1
29 21 23 1
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