ATOM 23
1 O2a O 30.8359 -18.7070
2 C1y C 29.4313 -19.7705
3 O2x O 28.2382 -19.0692
4 C1y C 29.4238 -21.1618
5 C1y C 27.0257 -19.7563
6 C1y C 28.2134 -21.8458
7 O1a O 30.6220 -21.8658
8 C1y C 27.0134 -21.1447
9 C1b C 25.8329 -19.0552
10 O1a O 28.2061 -23.2371
11 O1a O 25.8080 -21.8318
12 O1a O 24.6339 -19.7372
13 C1y C 29.6405 -16.6250
14 C1y C 29.6405 -15.2396
15 C1y C 30.8393 -17.3237
16 C1y C 28.3238 -17.0437
17 C2y C 30.8393 -14.5468
18 C1x C 28.3238 -14.8140
19 O2x O 32.0382 -16.6309
20 C1x C 27.5216 -15.9265
21 C1a C 27.1250 -17.7423
22 C2x C 32.0382 -15.2396
23 C1a C 30.8393 -13.1557
BOND 25
1 4 6 1
2 4 7 1 #Down
3 5 8 1
4 5 9 1 #Up
5 6 10 1 #Up
6 8 11 1 #Down
7 6 8 1
8 9 12 1
9 2 1 1 #Up
10 2 3 1
11 2 4 1
12 3 5 1
13 13 14 1
14 13 15 1
15 13 16 1
16 14 17 1
17 14 18 1
18 15 19 1
19 16 20 1
20 16 21 1 #Down
21 17 22 2
22 17 23 1
23 18 20 1
24 19 22 1
25 15 1 1 #Up
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