ATOM 23
1 C1y C 24.4710 -17.8986
2 C1z C 23.2444 -18.6053
3 C1y C 25.6741 -18.6053
4 C1x C 24.4710 -16.4969
5 C2y C 23.2444 -20.0244
6 C1x C 22.0297 -17.8986
7 C1a C 23.2444 -17.2854
8 C1y C 26.8831 -17.9219
9 C1x C 25.6741 -20.0244
10 C1x C 25.6741 -15.8311
11 C1x C 24.4710 -20.7253
12 C2x C 22.0297 -20.7253
13 C1x C 20.8207 -18.6053
14 C1z C 26.8831 -16.5494
15 C1b C 28.0980 -18.6286
16 C5x C 20.8207 -20.0244
17 O1a O 28.0863 -15.8486
18 C1a C 26.8831 -15.1069
19 O5x O 19.6294 -20.7312
20 C1b C 28.0942 -20.0121
21 C6a C 29.3010 -20.7036
22 O6a O 29.3010 -22.0940
23 O6a O 30.5100 -20.0031
BOND 25
1 2 5 1
2 2 6 1
3 2 7 1 #Up
4 3 8 1
5 3 9 1
6 4 10 1
7 5 11 1
8 5 12 2
9 6 13 1
10 8 14 1
11 8 15 1
12 12 16 1
13 14 17 1
14 14 18 1 #Up
15 16 19 2
16 9 11 1
17 10 14 1
18 13 16 1
19 15 20 1
20 1 2 1
21 20 21 1
22 1 3 1
23 21 22 2
24 1 4 1
25 21 23 1
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