ATOM 19
1 C8y C 21.7000 -14.7700
2 C8y C 21.7000 -16.1700
3 S2x S 22.8900 -14.1400
4 S2x S 20.3700 -14.3500
5 C1y C 22.8900 -16.8700
6 C8x C 20.3700 -16.5900
7 C1y C 24.0800 -14.7700
8 O3c O 21.6300 -13.2300
9 O3c O 24.0100 -13.3000
10 C8y C 19.6000 -15.4700
11 C1x C 24.0800 -16.1700
12 N1b N 22.8900 -18.2700
13 C1a C 25.2700 -14.1400
14 S4a S 18.2000 -15.4700
15 C1b C 24.0800 -18.9000
16 N1a N 18.2000 -17.0800
17 O3c O 18.2000 -14.1400
18 O3c O 16.7300 -15.4700
19 C1a C 24.0800 -20.3000
BOND 20
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 3 9 2
9 4 10 1
10 5 11 1
11 5 12 1 #Down
12 7 13 1 #Up
13 10 14 1
14 12 15 1
15 14 16 1
16 14 17 2
17 14 18 2
18 6 10 2
19 7 11 1
20 15 19 1
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