ATOM 43
1 C1y C 25.5740 -20.9267
2 O2x O 24.3638 -20.2230
3 C1y C 23.1484 -20.9299
4 C1y C 23.1503 -22.3332
5 C1y C 24.3675 -23.0297
6 C1y C 25.5759 -22.3300
7 C1y C 31.5339 -20.5801
8 O2x O 30.3167 -21.2767
9 C1y C 30.3088 -22.6766
10 C1y C 31.5181 -23.3797
11 C1y C 32.7354 -22.6903
12 C1y C 32.7434 -21.2904
13 C8y C 32.8353 -16.7401
14 C8y C 32.8282 -18.1404
15 C8x C 34.0383 -18.8430
16 C8x C 35.2482 -18.1525
17 C8x C 35.2553 -16.7523
18 C8x C 34.0523 -16.0425
19 C8x C 25.5740 -16.7261
20 C8x C 25.5740 -18.1262
21 C8y C 26.7906 -18.8228
22 C8y C 27.9998 -18.1262
23 C8y C 27.9998 -16.7261
24 C8y C 26.7906 -16.0224
25 C7a C 29.2047 -16.0295
26 O7a O 30.4149 -16.7330
27 C1b C 31.6250 -16.0365
28 O1a O 26.7922 -14.6222
29 O6a O 29.2064 -14.6293
30 O2a O 31.5412 -19.1809
31 O2a O 29.2140 -18.8219
32 C1a C 30.4269 -17.9145
33 O2a O 26.7922 -20.2230
34 C1b C 29.0913 -23.3662
35 C1b C 21.9339 -20.2279
36 O1a O 24.3693 -24.4300
37 O1a O 21.9377 -23.0314
38 O1a O 26.7904 -23.0250
39 O1a O 31.5101 -24.7800
40 O1a O 33.9448 -23.3938
41 O1a O 33.9607 -20.5936
42 O1a O 29.1484 -24.7595
43 O1a O 20.7213 -20.9331
BOND 46
1 19 20 1
2 20 21 2
3 21 22 1
4 22 23 2
5 23 24 1
6 24 19 2
7 12 7 1
8 23 25 1
9 6 1 1
10 25 26 1
11 26 27 1
12 27 13 1
13 1 2 1
14 24 28 1
15 2 3 1
16 25 29 2
17 3 4 1
18 14 30 1
19 7 30 1 #Up
20 4 5 1
21 22 31 1
22 13 14 2
23 31 32 1
24 14 15 1
25 21 33 1
26 1 33 1 #Up
27 15 16 2
28 9 34 1 #Up
29 16 17 1
30 3 35 1 #Up
31 17 18 2
32 5 36 1 #Up
33 18 13 1
34 4 37 1 #Down
35 5 6 1
36 6 38 1 #Down
37 7 8 1
38 10 39 1 #Down
39 8 9 1
40 11 40 1 #Up
41 9 10 1
42 12 41 1 #Down
43 10 11 1
44 34 42 1
45 11 12 1
46 35 43 1
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