ATOM 43
1 C8x C 24.1481 -16.7363
2 C8x C 24.1481 -18.1408
3 C8y C 25.3418 -18.8430
4 C8y C 26.6058 -18.1408
5 C8y C 26.6058 -16.7363
6 C8y C 25.3418 -16.0342
7 C5x C 27.7996 -18.8430
8 C2y C 28.9934 -18.1408
9 C2y C 28.9934 -16.7363
10 C5x C 27.7996 -16.0342
11 C1y C 30.2573 -18.8430
12 C1x C 31.4511 -18.1408
13 C8y C 31.4511 -16.7363
14 C8y C 30.2573 -16.0342
15 O2a O 25.3418 -20.2475
16 O5x O 27.7996 -20.2475
17 O1a O 30.2573 -20.2475
18 C8x C 32.6448 -16.0342
19 C8y C 32.6448 -14.6296
20 C8x C 31.4511 -13.9275
21 C8y C 30.2573 -14.6296
22 O1a O 29.0635 -13.9275
23 C1a C 33.8386 -13.9275
24 O5x O 27.8001 -14.6555
25 C1y C 24.1368 -20.9431
26 O2x O 22.9334 -20.2481
27 C1y C 21.7206 -20.9481
28 C1y C 21.7205 -22.3483
29 C1y C 22.9238 -23.0433
30 C1x C 24.1366 -22.3433
31 C1a C 20.4893 -20.2370
32 O1a O 22.9234 -24.4345
33 O2a O 20.5013 -23.0521
34 C1y C 19.2889 -23.7521
35 O2x O 18.0908 -23.0599
36 C1y C 16.8781 -23.7596
37 C1y C 16.8777 -25.1596
38 C1y C 18.0758 -25.8517
39 C1x C 19.2885 -25.1521
40 C1a C 15.6470 -23.0487
41 O1a O 18.0752 -27.2299
42 O1a O 15.6723 -25.8549
43 O1a O 25.3245 -14.6301
BOND 48
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 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 1
12 8 11 1
13 11 12 1
14 12 13 1
15 13 14 2
16 9 14 1
17 3 15 1
18 7 16 2
19 11 17 1 #Up
20 13 18 1
21 18 19 2
22 19 20 1
23 20 21 2
24 14 21 1
25 21 22 1
26 19 23 1
27 10 24 2
28 25 15 1 #Up
29 25 26 1
30 26 27 1
31 27 28 1
32 28 29 1
33 29 30 1
34 25 30 1
35 27 31 1 #Up
36 29 32 1 #Up
37 28 33 1 #Down
38 34 33 1 #Up
39 34 35 1
40 35 36 1
41 36 37 1
42 37 38 1
43 38 39 1
44 34 39 1
45 36 40 1 #Up
46 38 41 1 #Up
47 37 42 1 #Down
48 6 43 1
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