ATOM 47
1 C1z C 27.5096 -14.6890
2 O2a O 25.5616 -16.5260
3 O2x O 28.6758 -13.8492
4 C1y C 27.9352 -15.9893
5 C1b C 26.5300 -13.6918
6 C1y C 23.0246 -16.7359
7 C1y C 29.8013 -14.6656
8 C1y C 29.3522 -15.9893
9 O7a O 27.1131 -17.1264
10 O7a O 25.2529 -14.2748
11 O2x O 21.8001 -16.0360
12 C1y C 23.0246 -18.1354
13 C1b C 31.1366 -14.2457
14 O7a O 30.1629 -17.9723
15 C1y C 20.5988 -16.7418
16 C1y C 21.8001 -18.8351
17 O7a O 24.2257 -18.8351
18 O7a O 31.9763 -15.3711
19 C1y C 20.5988 -18.1354
20 C1b C 17.9860 -15.4760
21 O7a O 21.8001 -20.2346
22 O7a O 19.3860 -18.8351
23 C7a C 33.3765 -15.2058
24 C1a C 34.2111 -16.3239
25 O6a O 33.9371 -13.9013
26 C7a C 31.5621 -17.9812
27 C1a C 32.3789 -18.9927
28 C7a C 27.7525 -18.3833
29 C1a C 26.9675 -19.5905
30 O6a O 29.1525 -18.3833
31 O6a O 32.1678 -16.7240
32 C7a C 18.1746 -18.1352
33 C7a C 20.5674 -20.9467
34 O6a O 19.3572 -20.2483
35 C1a C 20.5678 -22.3299
36 C1a C 16.9833 -18.8226
37 C7a C 24.2257 -20.2351
38 O6a O 23.0112 -20.9363
39 C1a C 25.4317 -20.9313
40 C7a C 24.1265 -13.4723
41 C1a C 22.8845 -14.0387
42 O6a O 24.1229 -12.0446
43 O6a O 18.1749 -16.7302
44 O7a O 16.8329 -16.2582
45 C7a C 15.5392 -15.6314
46 C1a C 14.3912 -16.4101
47 O6a O 15.5063 -14.2138
BOND 48
1 1 2 1 #Down
2 1 3 1
3 1 4 1
4 1 5 1
5 6 2 1 #Down
6 3 7 1
7 4 8 1
8 4 9 1 #Down
9 5 10 1
10 6 11 1
11 6 12 1
12 7 13 1 #Down
13 8 14 1 #Up
14 11 15 1
15 12 16 1
16 12 17 1 #Down
17 13 18 1
18 15 19 1
19 15 20 1 #Up
20 16 21 1 #Up
21 19 22 1 #Down
22 7 8 1
23 16 19 1
24 18 23 1
25 23 24 1
26 23 25 2
27 14 26 1
28 26 27 1
29 9 28 1
30 28 29 1
31 28 30 2
32 26 31 2
33 22 32 1
34 21 33 1
35 33 34 2
36 33 35 1
37 32 36 1
38 17 37 1
39 37 38 2
40 37 39 1
41 10 40 1
42 40 41 1
43 40 42 2
44 32 43 2
45 20 44 1
46 44 45 1
47 45 46 1
48 45 47 2
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