ATOM 40
1 C8y C 29.9312 -21.4145
2 C8y C 31.2148 -20.7318
3 C8y C 29.9719 -22.8092
4 C8y C 28.7932 -20.7027
5 C8y C 32.4111 -21.4495
6 C8y C 31.2382 -19.3372
7 C8x C 28.7699 -23.5036
8 C1y C 31.1741 -23.5329
9 C8y C 27.5736 -21.3911
10 O1a O 28.7815 -19.3022
11 C1y C 32.3994 -22.8443
12 C8x C 33.7007 -20.7785
13 C8y C 32.4636 -18.6603
14 O1a O 30.0243 -18.6310
15 C8y C 27.5619 -22.7916
16 O1a O 31.1624 -24.9334
17 C5x C 26.3597 -20.6851
18 O1a O 33.6015 -23.5445
19 C8y C 33.6598 -19.3837
20 C5a C 32.4578 -17.2539
21 C5x C 26.3481 -23.4919
22 C8y C 25.1401 -21.3796
23 O5x O 26.4181 -19.2788
24 C1a C 34.8678 -18.6661
25 N1b N 33.6658 -16.5478
26 O5a O 31.2323 -16.5536
27 C8y C 25.1344 -22.7800
28 O5x O 26.3364 -24.8924
29 C8x C 23.9322 -20.6793
30 C1c C 33.6598 -15.1531
31 C8y C 23.9322 -23.4861
32 C8y C 22.7127 -21.3796
33 C6a C 34.8678 -14.4471
34 C1a C 32.4461 -14.4528
35 C8x C 22.7127 -22.7800
36 O1a O 23.9147 -24.8924
37 O2a O 21.4931 -20.6793
38 O6a O 36.0700 -15.1473
39 O6a O 34.8620 -13.0525
40 C1a C 20.2792 -21.3737
BOND 44
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 2
13 6 14 1
14 7 15 1
15 8 16 1 #Up
16 9 17 1
17 11 18 1 #Down
18 12 19 2
19 13 20 1
20 15 21 1
21 17 22 1
22 17 23 2
23 19 24 1
24 20 25 1
25 20 26 2
26 21 27 1
27 21 28 2
28 22 29 1
29 25 30 1
30 27 31 1
31 29 32 2
32 30 33 1
33 30 34 1
34 31 35 2
35 31 36 1
36 32 37 1
37 33 38 1
38 33 39 2
39 37 40 1
40 8 11 1
41 9 15 2
42 13 19 1
43 22 27 2
44 32 35 1
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