ATOM 41
1 C8y C 23.1700 -22.5400
2 C8y C 23.1700 -23.9400
3 C1x C 24.3600 -24.6400
4 C1y C 25.6200 -23.9400
5 C1y C 25.6200 -22.5400
6 O2x O 24.3600 -21.8400
7 C8x C 21.9800 -21.8400
8 C8y C 20.7200 -22.5400
9 C8y C 20.7200 -23.9400
10 C8y C 21.9800 -24.6400
11 O2x O 19.3900 -22.1200
12 C1y C 18.6200 -23.2400
13 C1y C 19.3900 -24.3600
14 O1a O 21.9800 -26.0400
15 O1a O 26.8100 -24.6400
16 C8y C 26.8100 -21.8400
17 C8y C 19.3900 -25.7600
18 C8x C 18.2000 -26.4600
19 C8x C 18.2000 -27.8600
20 C8y C 19.3900 -28.5600
21 C8y C 20.6500 -27.8600
22 C8x C 20.6500 -26.4600
23 O1a O 19.3900 -29.9600
24 O1a O 21.8400 -28.5600
25 C8y C 16.2400 -23.2400
26 C1b C 17.4300 -23.9400
27 C8y C 16.2400 -21.8400
28 C8x C 15.0276 -21.1400
29 C8y C 13.8151 -21.8400
30 C8x C 13.8151 -23.2400
31 C8y C 15.0276 -23.9400
32 O1a O 17.4524 -21.1400
33 O1a O 15.0276 -25.3398
34 O1a O 12.5840 -21.1290
35 C8x C 28.0281 -22.5301
36 C8y C 29.1648 -21.8203
37 C8y C 29.2234 -20.4203
38 C8x C 28.0053 -19.7302
39 C8x C 26.7986 -20.4400
40 O1a O 30.4136 -19.7597
41 O1a O 30.4021 -22.5405
BOND 46
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 2
8 7 8 1
9 8 9 2
10 9 10 1
11 2 10 2
12 8 11 1
13 11 12 1
14 12 13 1
15 9 13 1
16 10 14 1
17 4 15 1 #Up
18 5 16 1 #Down
19 13 17 1 #Up
20 17 18 1
21 18 19 2
22 19 20 1
23 20 21 2
24 21 22 1
25 17 22 2
26 20 23 1
27 21 24 1
28 25 26 1
29 12 26 1 #Up
30 25 27 1
31 27 28 2
32 28 29 1
33 29 30 2
34 30 31 1
35 25 31 2
36 27 32 1
37 31 33 1
38 29 34 1
39 16 35 2
40 35 36 1
41 36 37 2
42 37 38 1
43 38 39 2
44 16 39 1
45 37 40 1
46 36 41 1
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