ATOM 18
1 C1y C 26.8770 -20.7536
2 C1y C 28.2686 -20.7439
3 C1y C 29.1536 -21.8239
4 C1x C 28.8615 -23.1787
5 C1y C 26.0156 -21.8633
6 C1x C 27.6135 -23.8093
7 C2y C 26.3470 -23.2195
8 C2y C 30.4542 -21.3159
9 C7x C 30.4428 -19.9220
10 O7x O 29.0223 -19.5685
11 C2y C 26.0878 -19.5916
12 C1y C 24.7387 -19.9831
13 C1x C 24.6941 -21.3870
14 C2a C 26.0878 -18.1959
15 C2a C 25.2441 -24.1249
16 C2a C 31.6298 -22.0697
17 O1a O 23.6049 -19.1034
18 O6a O 31.5193 -19.0740
BOND 20
1 3 4 1
2 1 5 1
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 1
7 6 7 1
8 3 8 1
9 8 9 1
10 9 10 1
11 2 10 1
12 1 11 1
13 11 12 1
14 12 13 1
15 5 13 1
16 11 14 2
17 7 15 2
18 8 16 2
19 12 17 1 #Up
20 9 18 2
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