ATOM 24
1 C1y C 19.2500 -18.9000
2 C1x C 10.9900 -15.7500
3 C1x C 10.9900 -17.1500
4 C1x C 12.2024 -17.8500
5 C2y C 13.4149 -17.1500
6 C2y C 13.4149 -15.7500
7 C1z C 12.2024 -15.0500
8 C1x C 14.7464 -17.5826
9 C1y C 15.5693 -16.4500
10 C1y C 14.7464 -15.3174
11 C2y C 16.9008 -16.0174
12 C7x C 16.9008 -14.6174
13 O7x O 15.5693 -14.1847
14 C1a C 11.5024 -13.8376
15 C1a C 12.9024 -13.8376
16 O6a O 18.0071 -13.8133
17 C2b C 18.0188 -16.8301
18 O2a O 18.0188 -18.2301
19 C2x C 19.6123 -20.2523
20 C2y C 21.0104 -20.3256
21 C7x C 21.5122 -19.0185
22 O7x O 20.4242 -18.1375
23 O6a O 22.8384 -18.6635
24 C1a C 21.7582 -21.4769
BOND 27
1 2 3 1
2 3 4 1
3 4 5 1
4 5 6 2
5 6 7 1
6 2 7 1
7 5 8 1
8 8 9 1
9 9 10 1
10 6 10 1
11 11 12 1
12 12 13 1
13 10 13 1 #Up
14 9 11 1 #Up
15 7 14 1
16 7 15 1
17 12 16 2
18 11 17 2
19 17 18 1
20 1 18 1 #Down
21 1 19 1
22 19 20 2
23 20 21 1
24 21 22 1
25 1 22 1
26 21 23 2
27 20 24 1
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