ATOM 17
1 C1y C 16.1914 -17.1684
2 C1y C 17.5871 -17.1684
3 C1y C 18.0059 -15.8424
4 O2x O 16.8892 -15.0746
5 C1y C 15.7726 -15.8424
6 C1b C 14.4465 -15.4237
7 C8y C 19.3319 -15.4237
8 O1a O 15.3539 -18.3548
9 O1a O 18.4246 -18.3548
10 O1a O 13.3997 -16.4007
11 N5x N 20.5183 -16.2611
12 C8y C 21.6349 -15.4237
13 C8x C 21.2162 -14.0976
14 S2x S 19.8204 -14.0976
15 C5a C 22.8911 -15.8424
16 N1a N 23.9379 -14.9350
17 O5a O 23.2400 -17.2382
BOND 18
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 5 6 1 #Up
7 3 7 1 #Up
8 1 8 1 #Down
9 2 9 1 #Down
10 6 10 1
11 7 11 2
12 11 12 1
13 12 13 2
14 13 14 1
15 7 14 1
16 12 15 1
17 15 16 1
18 15 17 2
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