ATOM 43
1 C8y C 23.9714 -19.7422
2 C8y C 23.5488 -18.4130
3 C2b C 25.1781 -20.4444
4 N4x N 22.8535 -20.5602
5 C8y C 22.1513 -18.4130
6 C1b C 24.2307 -17.2064
7 C2y C 26.3915 -19.7422
8 C8y C 21.7083 -19.7422
9 C1a C 21.4425 -17.1927
10 C1b C 23.5352 -16.0203
11 C2y C 26.8210 -18.4060
12 N2x N 27.5301 -20.5602
13 C1b C 20.5015 -20.4513
14 C6a C 23.5215 -14.6227
15 C2y C 28.2252 -18.4060
16 C1b C 26.1327 -17.1994
17 C2y C 28.6618 -19.7422
18 C1y C 19.3043 -19.7559
19 O6a O 22.3082 -13.9344
20 O6a O 24.7215 -13.9274
21 C1a C 28.9276 -17.1789
22 C1b C 26.8142 -15.9793
23 C1b C 29.8547 -20.4239
24 C2y C 18.8727 -18.4197
25 N1x N 18.1707 -20.5805
26 C6a C 26.8142 -14.5819
27 C1y C 31.0748 -19.7286
28 C2y C 17.4610 -18.4197
29 C1b C 19.5751 -17.1994
30 C5x C 17.0368 -19.7559
31 O6a O 28.0210 -13.8798
32 O6a O 25.5871 -13.8932
33 C2y C 31.4976 -18.3857
34 N1x N 32.2133 -20.5534
35 C1a C 17.1027 -17.0565
36 C1a C 19.2020 -15.8362
37 O5x O 15.8155 -20.4444
38 C2y C 32.9084 -18.3857
39 C1a C 30.8023 -17.1723
40 C5x C 33.3311 -19.7286
41 C2b C 33.6108 -17.1723
42 O5x O 34.5447 -20.4171
43 C2a C 32.9018 -15.9453
BOND 46
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 4 8 1
8 5 9 1
9 6 10 1
10 7 11 1
11 7 12 1
12 8 13 1
13 10 14 1
14 11 15 2
15 11 16 1
16 12 17 2
17 13 18 1
18 14 19 1
19 14 20 2
20 15 21 1
21 16 22 1
22 17 23 1
23 18 24 1
24 18 25 1
25 22 26 1
26 23 27 1
27 24 28 2
28 24 29 1
29 25 30 1
30 26 31 1
31 26 32 2
32 27 33 1
33 27 34 1
34 28 35 1
35 29 36 1
36 30 37 2
37 33 38 2
38 33 39 1
39 34 40 1
40 38 41 1
41 40 42 2
42 41 43 2
43 5 8 2
44 15 17 1
45 28 30 1
46 38 40 1
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