ATOM 20
1 C1z C 26.9049 -20.4230
2 C8y C 28.0553 -21.0852
3 C1y C 26.9106 -19.0855
4 C1x C 25.7309 -19.7548
5 N1y N 25.7483 -21.0912
6 C8y C 29.2177 -20.4347
7 C8x C 28.0377 -22.4158
8 C1y C 28.0670 -18.4233
9 C1x C 25.7309 -18.4174
10 C1y C 26.7050 -17.0716
11 C1x C 24.5977 -20.4230
12 C1a C 25.7426 -22.4215
13 C1x C 29.2234 -19.0914
14 N4x N 30.3624 -21.1203
15 C8x C 29.1826 -23.0956
16 C1x C 28.0625 -17.0716
17 C1x C 24.5977 -19.0855
18 C8y C 30.4149 -22.4508
19 O5x O 31.5011 -23.1073
20 C1a C 25.9240 -15.9623
BOND 23
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 1 5 1
5 2 6 2
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 6 14 1
14 7 15 2
15 8 16 1 #Up
16 9 17 1
17 14 18 1
18 18 19 2
19 8 13 1
20 11 17 1
21 15 18 1
22 16 10 1
23 10 20 1 #Down
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