ATOM 22
1 C1y C 24.6846 -20.4952
2 C1y C 23.4646 -21.2040
3 O2a O 25.9366 -21.2617
4 C1x C 24.6846 -19.0897
5 C1x C 22.2637 -20.4952
6 C1c C 23.4136 -22.3602
7 C1y C 27.4952 -22.1239
8 C1y C 23.4646 -18.3936
9 C1x C 22.2637 -19.0897
10 C1a C 22.2127 -23.0500
11 C1a C 24.6143 -23.0565
12 O2x O 28.7088 -21.4276
13 C1y C 27.4952 -23.5164
14 C1a C 23.4646 -17.0778
15 C1y C 29.9096 -22.1239
16 C1y C 28.7088 -24.2127
17 O1a O 26.2878 -24.2127
18 C1y C 29.9096 -23.5164
19 C1b C 31.1042 -21.4276
20 O1a O 28.7088 -25.5986
21 O1a O 31.1042 -24.2127
22 O1a O 32.1645 -22.3283
BOND 23
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 1 #Down
6 7 3 1 #Down
7 4 8 1
8 5 9 1
9 6 10 1
10 6 11 1
11 7 12 1
12 7 13 1
13 8 14 1 #Up
14 12 15 1
15 13 16 1
16 13 17 1 #Up
17 15 18 1
18 15 19 1 #Down
19 16 20 1 #Down
20 18 21 1 #Up
21 19 22 1
22 8 9 1
23 16 18 1
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