ATOM 62
1 O2x O 27.9455 -15.2561
2 C1z C 29.3289 -15.5485
3 C1y C 30.1034 -16.7289
4 C1x C 29.8108 -18.1124
5 C1x C 28.6235 -18.8853
6 C1x C 27.2400 -18.5929
7 C2x C 24.5318 -14.5589
8 C2x C 25.9175 -14.8408
9 C1y C 26.7010 -16.0151
10 C1y C 26.4191 -17.4008
11 O2x O 25.2377 -18.1828
12 C1x C 23.3587 -15.3353
13 C1x C 18.2457 -16.0249
14 C1y C 19.6546 -16.0306
15 C1y C 20.5383 -17.1338
16 C1y C 17.3614 -17.1386
17 O2x O 18.9571 -19.1263
18 C1y C 17.6816 -18.5150
19 O2x O 21.7948 -16.4619
20 C1y C 23.1697 -16.7920
21 C1y C 23.9117 -17.9930
22 C1x C 23.6311 -19.1619
23 C2x C 22.7857 -20.2071
24 C2x C 21.3448 -20.1518
25 C1y C 20.2982 -18.4343
26 C1x C 20.5207 -19.3431
27 C1y C 15.2981 -19.0694
28 C1x C 16.6498 -19.4804
29 C1x C 13.8207 -17.0355
30 C1z C 14.9917 -17.7392
31 O2x O 14.5805 -20.3023
32 C1y C 13.2349 -20.6625
33 C1y C 12.0639 -19.9586
34 C1x C 11.7562 -18.6050
35 C1y C 12.4845 -17.3930
36 O2x O 15.9572 -16.4948
37 C1a C 14.5904 -16.3845
38 C1a C 20.2802 -14.7345
39 O7x O 11.0328 -20.8548
40 C7x C 11.5663 -22.1125
41 C1x C 12.9274 -21.9936
42 C1a C 11.6507 -16.2858
43 O6a O 10.8354 -23.3286
44 O2x O 31.5140 -16.6483
45 C1y C 32.1495 -15.3864
46 C1y C 31.3750 -14.2061
47 C1x C 29.9644 -14.2866
48 C1x C 33.5601 -15.3058
49 C1y C 34.1957 -14.0439
50 C1y C 33.4212 -12.8635
51 O2x O 32.0105 -12.9441
52 O2x O 35.6063 -13.9633
53 C1y C 36.2418 -12.7014
54 C1x C 35.4673 -11.5210
55 C1y C 34.0567 -11.6015
56 O1a O 33.2829 -10.4221
57 C1b C 37.6865 -12.6184
58 C1a C 28.9633 -14.1837
59 C2c C 38.4746 -13.8185
60 C2a C 39.8757 -13.7381
61 C4a C 37.8274 -15.1046
62 O4a O 36.4198 -15.1854
BOND 71
1 2 1 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 7 8 2
7 8 9 1
8 11 10 1
9 12 7 1
10 13 16 1
11 14 15 1
12 16 18 1
13 13 14 1
14 18 17 1
15 21 22 1
16 22 23 1
17 23 24 2
18 25 26 1
19 26 24 1
20 20 19 1
21 15 19 1
22 25 17 1
23 15 25 1
24 27 28 1
25 18 28 1
26 29 30 1
27 32 31 1
28 32 33 1
29 33 34 1
30 34 35 1
31 35 29 1
32 30 27 1
33 27 31 1
34 30 36 1
35 16 36 1
36 30 37 1 #Down
37 14 38 1 #Down
38 33 39 1 #Up
39 39 40 1
40 40 41 1
41 32 41 1
42 35 42 1 #Up
43 40 43 2
44 12 20 1
45 21 11 1
46 20 21 1
47 9 1 1
48 6 10 1
49 9 10 1
50 3 44 1
51 45 44 1
52 45 46 1
53 46 47 1
54 2 47 1
55 45 48 1
56 48 49 1
57 49 50 1
58 50 51 1
59 46 51 1
60 49 52 1
61 52 53 1
62 53 54 1
63 54 55 1
64 50 55 1
65 55 56 1 #Up
66 53 57 1
67 2 58 1 #Down
68 57 59 1
69 59 60 2
70 59 61 1
71 61 62 2
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