ATOM 66
1 C1y C 12.8655 -9.3742
2 C1y C 12.8980 -10.7508
3 O2x O 15.3410 -9.2786
4 C1y C 14.1537 -11.4507
5 O1a O 11.7114 -11.4869
6 C1y C 15.3403 -10.7146
7 N1b N 14.1861 -12.8273
8 C1b C 14.0197 -7.2615
9 O1a O 12.6963 -6.8501
10 O1a O 11.6466 -8.7337
11 C1y C 14.0521 -8.6381
12 O2a O 26.5244 -9.9374
13 C1y C 18.0558 -17.6361
14 C1y C 18.0558 -19.0359
15 O2a O 19.2456 -16.9362
16 O2x O 16.7960 -16.9362
17 C1y C 16.7960 -19.7358
18 N1b N 19.2456 -19.7358
19 C1y C 19.2456 -15.5365
20 C1y C 15.6062 -17.6361
21 C1y C 15.6062 -19.0359
22 O1a O 16.7960 -21.1355
23 C1y C 20.5054 -14.8366
24 C1y C 18.0558 -14.8366
25 C1b C 14.4164 -16.9362
26 O2a O 14.4164 -19.7358
27 C1y C 20.5054 -13.4368
28 O1a O 21.6952 -15.5365
29 C1y C 18.0558 -13.4368
30 O1a O 16.8660 -15.5365
31 C1y C 13.2266 -20.4356
32 O2a O 21.6952 -12.7369
33 O2x O 19.2456 -12.7369
34 C1b C 16.8660 -12.7369
35 O2x O 11.9668 -19.7358
36 C1y C 13.2266 -21.8354
37 C1y C 22.8850 -12.0370
38 C1y C 10.7770 -20.4356
39 C1y C 11.9668 -22.5353
40 O1a O 14.4164 -22.5353
41 C1y C 22.8850 -10.6373
42 C1y C 24.0748 -12.7369
43 C1y C 10.7770 -21.8354
44 C1b C 9.5872 -19.7358
45 O1a O 11.9668 -23.9351
46 O2x O 24.0748 -9.9374
47 C1b C 21.6952 -9.9374
48 C1y C 25.3346 -12.0370
49 O1a O 24.0748 -14.1367
50 O1a O 9.5872 -22.5353
51 C1y C 25.3346 -10.6373
52 O1a O 20.6454 -10.8472
53 N1b N 26.5244 -12.7369
54 C5a C 20.5054 -19.1059
55 C1a C 21.6952 -19.8058
56 O5a O 20.4354 -17.7061
57 O1a O 13.1566 -17.6361
58 O1a O 8.3274 -20.4356
59 R R 26.5244 -8.3976
60 C5a C 27.7142 -12.0370
61 C1a C 28.9040 -12.7369
62 O5a O 27.6442 -10.6373
63 O2a O 16.8660 -11.3369
64 C5a C 13.0113 -13.5333
65 C1a C 13.0113 -14.9333
66 O5a O 11.7895 -12.8422
BOND 70
1 1 2 1
2 2 4 1
3 2 5 1 #Up
4 3 6 1
5 8 9 1
6 4 7 1 #Down
7 4 6 1
8 11 8 1 #Up
9 1 10 1 #Down
10 11 3 1
11 1 11 1
12 13 14 1
13 13 15 1 #Up
14 13 16 1
15 14 17 1
16 14 18 1 #Down
17 19 15 1 #Up
18 16 20 1
19 17 21 1
20 17 22 1 #Up
21 19 23 1
22 19 24 1
23 20 25 1 #Up
24 21 26 1 #Down
25 23 27 1
26 23 28 1 #Down
27 24 29 1
28 24 30 1 #Up
29 31 26 1 #Up
30 27 32 1 #Up
31 27 33 1
32 29 34 1 #Up
33 31 35 1
34 31 36 1
35 37 32 1 #Down
36 35 38 1
37 36 39 1
38 36 40 1 #Down
39 37 41 1
40 37 42 1
41 38 43 1
42 38 44 1 #Up
43 39 45 1 #Up
44 41 46 1
45 41 47 1 #Up
46 42 48 1
47 42 49 1 #Up
48 43 50 1 #Up
49 46 51 1
50 47 52 1
51 48 53 1 #Down
52 51 12 1 #Up
53 20 21 1
54 29 33 1
55 39 43 1
56 48 51 1
57 18 54 1
58 54 55 1
59 54 56 2
60 25 57 1
61 44 58 1
62 12 59 1
63 53 60 1
64 60 61 1
65 60 62 2
66 34 63 1
67 6 63 1 #Up
68 7 64 1
69 64 65 1
70 64 66 2
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