ATOM 21
1 N1y N 25.5862 -18.2405
2 C1y C 25.5862 -16.8378
3 C2y C 26.9187 -18.6612
4 C5x C 24.1836 -18.2405
5 C1y C 24.1836 -16.8378
6 C1x C 26.9187 -16.4170
7 C2y C 27.7603 -17.5391
8 C6a C 27.3394 -19.9937
9 O5x O 23.2018 -19.2223
10 C1c C 22.9913 -16.1365
11 S2a S 29.1630 -17.5391
12 O6a O 28.7421 -20.2743
13 O6a O 26.4278 -21.0457
14 C1b C 30.3551 -16.8378
15 C1b C 31.5474 -17.5391
16 N1b N 32.8098 -16.8378
17 C1a C 21.7992 -16.8378
18 C1a C 22.9906 -14.7703
19 C5a C 34.0397 -17.5748
20 C1a C 35.2502 -16.9017
21 O5a O 34.0170 -18.9700
BOND 22
1 1 2 1
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 5 10 1 #Down
10 7 11 1
11 8 12 1
12 8 13 2
13 11 14 1
14 14 15 1
15 15 16 1
16 4 5 1
17 6 7 1
18 10 17 1
19 10 18 1
20 16 19 1
21 19 20 1
22 19 21 2
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