ATOM 51
1 O1a O 37.2437 -21.2733
2 C1z C 35.7761 -21.9033
3 C1a C 36.9251 -23.0323
4 C1y C 15.4184 -12.7523
5 C1y C 14.2205 -13.4611
6 C1y C 14.2339 -14.8601
7 C1x C 15.4489 -15.5373
8 C1y C 16.6470 -14.8285
9 O2x O 16.6299 -13.4425
10 O2a O 17.8587 -15.5005
11 O1a O 13.0372 -15.5710
12 O1a O 13.0079 -12.7775
13 C1a C 15.4070 -11.3605
14 C1y C 19.0625 -16.1993
15 C1x C 19.0625 -17.5913
16 C1x C 20.2733 -18.2922
17 C1y C 21.4749 -17.5913
18 O2x O 21.4749 -16.1993
19 C1y C 20.2733 -15.5082
20 C1a C 20.2756 -14.1163
21 O2a O 22.6818 -18.2847
22 C1y C 25.0631 -15.4660
23 C1y C 23.8650 -16.1748
24 C1y C 23.8786 -17.5738
25 C1x C 25.0935 -18.2510
26 C1y C 26.2914 -17.5422
27 O2x O 26.3446 -16.1562
28 C8y C 27.5031 -18.2140
29 O1a O 22.6525 -15.4912
30 C1a C 25.0515 -14.0740
31 C8y C 34.4955 -19.6819
32 C8y C 33.2171 -20.4205
33 C5x C 33.2183 -21.9051
34 C1x C 34.4977 -22.6324
35 C1x C 35.7749 -20.4186
36 C8y C 31.9388 -18.1951
37 C8y C 31.9388 -19.6819
38 C8y C 34.4998 -18.1951
39 C8x C 33.2194 -17.4565
40 C8x C 27.4979 -19.6912
41 C8x C 28.6151 -20.3161
42 C8y C 29.7230 -19.6912
43 C5x C 30.8309 -20.3161
44 C8y C 28.6058 -17.5702
45 C8y C 29.7230 -18.2047
46 C5x C 30.8216 -17.5606
47 O1a O 28.5963 -16.1782
48 O5x O 30.8120 -16.1687
49 O5x O 30.7675 -21.7177
50 O5x O 32.0052 -22.5794
51 O1a O 35.7738 -17.4470
BOND 57
1 2 1 1 #Up
2 2 3 1 #Down
3 26 28 1 #Up
4 24 21 1 #Up
5 8 10 1 #Up
6 23 29 1 #Down
7 4 5 1
8 22 30 1 #Up
9 14 15 1
10 15 16 1
11 16 17 1
12 17 18 1
13 18 19 1
14 19 14 1
15 31 32 2
16 32 33 1
17 33 34 1
18 34 2 1
19 2 35 1
20 35 31 1
21 6 11 1 #Up
22 19 20 1 #Down
23 14 10 1 #Down
24 5 6 1
25 36 37 2
26 37 32 1
27 31 38 1
28 38 39 2
29 39 36 1
30 17 21 1 #Up
31 5 12 1 #Down
32 40 41 1
33 6 7 1
34 41 42 2
35 4 13 1 #Up
36 42 43 1
37 43 37 1
38 40 28 2
39 7 8 1
40 28 44 1
41 8 9 1
42 44 45 2
43 9 4 1
44 45 46 1
45 46 36 1
46 22 23 1
47 44 47 1
48 23 24 1
49 46 48 2
50 42 45 1
51 24 25 1
52 43 49 2
53 25 26 1
54 33 50 2
55 26 27 1
56 27 22 1
57 38 51 1
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