ATOM 39
1 C8y C 24.2406 -24.2675
2 C8x C 24.2406 -25.6742
3 C8y C 25.4588 -26.3775
4 C8y C 26.6771 -25.6742
5 C8y C 26.6771 -24.2675
6 C8y C 25.4588 -23.5642
7 C8y C 27.8952 -26.3775
8 C8x C 29.1134 -25.6742
9 C8y C 29.1134 -24.2675
10 O2x O 27.8952 -23.5642
11 C1b C 30.3166 -23.5728
12 C5a C 31.5106 -24.2620
13 C1a C 32.7070 -23.5712
14 O5a O 31.5107 -25.6740
15 O5x O 27.8952 -27.7841
16 O1a O 23.0225 -23.5642
17 C1a C 25.4588 -27.7839
18 C1y C 25.4588 -22.1578
19 O2x O 26.6601 -21.4640
20 C1y C 26.6599 -20.0574
21 C1y C 25.4416 -19.3542
22 C1y C 24.2404 -20.0479
23 C1y C 24.2405 -21.4546
24 C1b C 27.8609 -19.3634
25 O1a O 23.0222 -19.3448
26 O1a O 25.4415 -17.9377
27 O7a O 23.0227 -22.1579
28 C7a C 21.8211 -21.4642
29 C2b C 20.6285 -22.1530
30 O6a O 21.8208 -20.0479
31 C2b C 19.4312 -21.4617
32 C8y C 18.2365 -22.1517
33 C8x C 17.0404 -21.4610
34 C8x C 15.8222 -22.1643
35 C8y C 15.8221 -23.5710
36 C8x C 17.0183 -24.2615
37 C8x C 18.2364 -23.5583
38 O1a O 14.5910 -24.2819
39 O1a O 27.8605 -17.9900
BOND 42
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 12 14 2
16 7 15 2
17 1 16 1
18 3 17 1
19 18 6 1 #Up
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 18 23 1
26 20 24 1 #Up
27 22 25 1 #Up
28 21 26 1 #Down
29 23 27 1 #Down
30 27 28 1
31 28 29 1
32 28 30 2
33 29 31 2
34 31 32 1
35 32 33 1
36 33 34 2
37 34 35 1
38 35 36 2
39 36 37 1
40 32 37 2
41 35 38 1
42 24 39 1
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