ATOM 17
1 C1x C 28.5647 -14.8498
2 C1y C 28.1455 -16.1846
3 C7x C 29.2881 -16.9868
4 O7x O 30.4087 -16.1546
5 C1x C 29.9617 -14.8311
6 C1a C 17.2228 -16.8801
7 C1b C 18.4365 -16.1814
8 C1b C 19.6505 -16.8801
9 C1b C 20.8644 -16.1814
10 C1b C 22.0781 -16.8801
11 C5a C 23.2920 -16.1814
12 C1b C 24.5059 -16.8801
13 C5a C 25.7197 -16.1814
14 N1b N 26.9265 -16.8801
15 O5a O 25.7197 -14.7769
16 O5a O 23.2920 -14.7769
17 O6a O 29.2367 -18.3909
BOND 17
1 8 9 1
2 4 5 1
3 9 10 1
4 5 1 1
5 10 11 1
6 11 12 1
7 1 2 1
8 12 13 1
9 6 7 1
10 13 14 1
11 2 14 1 #Up
12 2 3 1
13 13 15 2
14 7 8 1
15 11 16 2
16 3 4 1
17 3 17 2
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