ATOM 16
1 C1c C 18.6900 -17.5000
2 C6a C 18.6900 -18.9000
3 N1x N 20.0900 -18.9000
4 C1y C 20.0900 -17.5000
5 C1y C 21.4215 -19.3326
6 C1z C 22.2444 -18.2000
7 S2x S 21.4215 -17.0674
8 N1b N 17.2900 -17.5000
9 C1a C 23.2343 -17.2101
10 C1a C 23.2343 -19.1899
11 C6a C 21.8503 -20.6522
12 O6a O 23.2094 -20.9411
13 O6a O 20.9101 -21.6965
14 O6a O 17.7800 -20.2300
15 O6a O 17.2900 -18.9000
16 R R 16.5900 -16.2876
BOND 16
1 1 2 1
2 3 4 1
3 1 4 1
4 3 5 1
5 5 6 1
6 6 7 1
7 4 7 1
8 1 8 1 #Up
9 6 9 1 #Up
10 6 10 1 #Down
11 5 11 1 #Down
12 11 12 2
13 11 13 1
14 2 14 2
15 2 15 1
16 8 16 1
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