ATOM 24
1 C8y C 32.1650 -16.1995
2 C8x C 32.1650 -17.6016
3 C8x C 33.3792 -18.3026
4 C8y C 34.5934 -17.6016
5 C8y C 34.5934 -16.1995
6 C8x C 33.3792 -15.4985
7 O2a O 35.8263 -15.4875
8 C1a C 35.8263 -14.0855
9 O2a O 35.8263 -18.3136
10 C2b C 30.9508 -15.4985
11 C2b C 29.7536 -16.1899
12 C1b C 28.5644 -15.5034
13 C1y C 37.0405 -19.0147
14 O2x O 37.0408 -20.4053
15 C1y C 38.2552 -21.1061
16 C1y C 39.4693 -20.4049
17 C1y C 39.4690 -19.0143
18 C1y C 38.2546 -18.3134
19 C1b C 38.2554 -22.5088
20 O1a O 39.4761 -23.2133
21 O1a O 40.6736 -21.1001
22 O1a O 40.6775 -18.3161
23 O1a O 38.2543 -16.9006
24 O1a O 28.5644 -14.1034
BOND 25
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 1
9 4 9 1
10 1 10 1
11 10 11 2
12 11 12 1
13 13 9 1 #Up
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 13 18 1
20 15 19 1 #Up
21 19 20 1
22 16 21 1 #Down
23 17 22 1 #Up
24 18 23 1 #Down
25 12 24 1
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