ATOM 70
1 N1y N 20.5800 -25.2000
2 C1y C 21.7700 -24.5000
3 C5a C 20.5800 -26.6000
4 C1x C 19.3200 -24.5000
5 C7a C 22.9600 -25.2000
6 C1x C 21.7700 -23.1000
7 C5a C 19.3200 -27.3000
8 O5a O 21.7700 -27.3000
9 C1x C 19.3200 -23.1000
10 O7a O 24.1500 -24.5000
11 O6a O 22.9600 -26.3200
12 C1x C 20.5800 -22.4000
13 C1z C 19.3200 -28.7000
14 O5a O 18.1300 -26.6000
15 C1c C 25.4100 -25.2000
16 O2x O 20.5100 -29.4000
17 C1y C 17.9900 -29.4000
18 O1a O 19.3200 -30.1000
19 C1c C 26.6000 -24.5000
20 C1b C 25.4100 -26.6000
21 C1y C 20.5100 -30.8000
22 C1x C 17.9900 -30.8000
23 C1a C 16.6600 -28.7000
24 C1b C 27.7900 -25.2000
25 C1a C 26.6000 -23.1000
26 C5a C 26.6000 -27.3000
27 C1b C 21.7000 -31.5000
28 C1x C 19.3200 -31.5000
29 C1y C 28.9800 -24.5000
30 C1c C 26.6000 -28.7000
31 O5a O 27.7900 -26.6000
32 C1c C 21.7000 -32.9000
33 C1x C 30.2400 -25.2000
34 C1x C 28.9800 -23.1000
35 C2b C 27.7900 -29.4000
36 C1a C 25.4100 -29.4000
37 C2c C 22.8900 -33.6000
38 O2a O 20.5100 -33.6000
39 C1y C 31.4300 -24.5000
40 C1x C 30.2400 -22.4000
41 C2c C 27.7900 -30.8000
42 C2b C 22.8900 -35.0000
43 C1a C 24.1500 -32.9000
44 C1a C 20.5100 -35.0000
45 C1y C 31.4300 -23.1000
46 O2a O 32.6200 -25.2000
47 C1c C 28.9800 -31.5000
48 C1a C 26.6000 -31.5000
49 C2b C 24.0800 -35.7000
50 O2a O 32.6200 -22.4000
51 C1a C 33.8100 -24.5000
52 C1c C 28.9800 -32.8300
53 O1a O 30.2400 -30.7300
54 C2b C 24.0800 -37.1000
55 C5a C 30.2400 -33.5300
56 O2a O 27.7900 -33.5300
57 C2b C 25.2700 -37.8000
58 C1c C 30.2400 -34.9300
59 O5a O 31.4300 -32.8300
60 C1a C 27.7900 -34.9300
61 C2b C 26.5300 -37.1000
62 C1b C 28.9800 -35.6300
63 C1a C 31.4300 -35.6300
64 C1c C 27.9300 -37.1000
65 C1a C 28.2800 -38.4300
66 C1b C 33.8381 -23.0901
67 C1b C 35.0195 -22.3950
68 O2a O 36.2249 -23.0780
69 C1b C 37.3961 -22.3891
70 C1a C 38.6065 -23.0751
BOND 73
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1 #Up
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 1
9 5 10 1
10 5 11 2
11 6 12 1
12 7 13 1
13 7 14 2
14 10 15 1
15 13 16 1 #Down
16 13 17 1
17 13 18 1 #Up
18 15 19 1
19 15 20 1
20 21 16 1 #Down
21 17 22 1
22 17 23 1 #Up
23 19 24 1
24 19 25 1 #Down
25 20 26 1
26 21 27 1
27 21 28 1
28 24 29 1
29 26 30 1
30 26 31 2
31 27 32 1
32 29 33 1
33 29 34 1
34 30 35 1
35 30 36 1 #Up
36 32 37 1
37 32 38 1 #Up
38 33 39 1
39 34 40 1
40 35 41 2
41 37 42 2
42 37 43 1
43 38 44 1
44 39 45 1
45 39 46 1 #Down
46 41 47 1
47 41 48 1
48 42 49 1
49 45 50 1 #Up
50 46 51 1
51 47 52 1
52 47 53 1 #Up
53 49 54 2
54 52 55 1
55 52 56 1 #Down
56 54 57 1
57 55 58 1
58 55 59 2
59 56 60 1
60 57 61 2
61 58 62 1
62 58 63 1 #Down
63 61 64 1
64 64 65 1 #Down
65 9 12 1
66 22 28 1
67 40 45 1
68 62 64 1
69 50 66 1
70 66 67 1
71 67 68 1
72 68 69 1
73 69 70 1
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