ATOM 39
1 C1y C 24.6400 -20.0900
2 C1y C 23.4500 -19.3900
3 C1y C 23.4500 -17.9900
4 C1y C 24.7100 -17.2900
5 C1y C 25.8300 -18.0600
6 O2x O 25.8300 -19.4600
7 O1a O 22.1900 -20.0900
8 O1a O 22.2600 -17.2900
9 O1a O 24.7100 -15.8900
10 C1b C 27.0900 -17.3600
11 O1a O 27.1600 -15.9600
12 C8y C 24.5700 -21.4900
13 C8y C 25.8300 -22.1900
14 C8y C 25.8300 -23.5900
15 O2x O 27.0200 -21.4900
16 C8y C 23.3800 -22.1900
17 C8y C 27.0200 -24.2900
18 C8x C 24.5700 -24.2900
19 C8x C 28.2100 -22.1900
20 C8x C 23.3800 -23.5900
21 O2a O 22.1900 -21.4900
22 C8y C 28.2100 -23.6600
23 O5x O 27.0200 -25.6900
24 C8y C 29.4700 -24.3600
25 C8x C 29.4700 -25.6900
26 C8x C 30.6600 -23.6600
27 C8x C 30.6600 -26.4600
28 C8x C 31.8500 -24.3600
29 C8y C 31.8500 -25.7600
30 O1a O 33.0400 -26.4600
31 C1y C 20.9719 -22.1801
32 O2x O 19.8605 -21.4850
33 C1x C 18.6423 -22.1750
34 C1y C 18.6308 -23.5750
35 C1y C 19.8123 -24.2701
36 C1y C 21.0304 -23.5801
37 O1a O 22.2350 -24.2493
38 O1a O 17.3980 -24.2732
39 O1a O 19.8007 -25.6900
BOND 43
1 4 9 1 #Down
2 5 10 1 #Up
3 10 11 1
4 1 12 1 #Up
5 1 2 1
6 2 3 1
7 3 4 1
8 4 5 1
9 5 6 1
10 6 1 1
11 2 7 1 #Down
12 3 8 1 #Up
13 13 12 1
14 13 14 2
15 13 15 1
16 12 16 2
17 14 17 1
18 14 18 1
19 15 19 1
20 16 20 1
21 16 21 1
22 17 22 1
23 17 23 2
24 22 24 1
25 24 25 2
26 24 26 1
27 25 27 1
28 26 28 2
29 27 29 2
30 29 30 1
31 18 20 2
32 19 22 2
33 28 29 1
34 31 21 1 #Down
35 31 32 1
36 32 33 1
37 33 34 1
38 34 35 1
39 35 36 1
40 31 36 1
41 36 37 1 #Down
42 34 38 1 #Down
43 35 39 1 #Up
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