ATOM 61
1 S2a S 14.3500 -20.4400
2 C5a C 13.1600 -19.7400
3 C2b C 11.9700 -20.4400
4 O5a O 13.1600 -18.3400
5 C2b C 10.7800 -19.7400
6 C8y C 9.5900 -20.4400
7 C8x C 9.3800 -21.8400
8 N4x N 8.0500 -22.1200
9 C8y C 7.3500 -20.8600
10 C8y C 8.2600 -19.8800
11 C8x C 5.9500 -20.5800
12 C8x C 5.5300 -19.2500
13 C8x C 6.5100 -18.2000
14 C8x C 7.8400 -18.4800
15 C1b C 15.5400 -19.7400
16 C1b C 16.8000 -20.4400
17 N1b N 17.9900 -19.7400
18 C5a C 19.1800 -20.4400
19 C1b C 20.4400 -19.7400
20 C1b C 21.6300 -20.4400
21 N1b N 22.8200 -19.7400
22 C5a C 24.0800 -20.4400
23 C1c C 25.2700 -19.7400
24 C1d C 26.4600 -20.4400
25 C1b C 27.6500 -19.7400
26 O2b O 28.9100 -20.4400
27 O5a O 19.1800 -21.8400
28 O5a O 24.0800 -21.8400
29 O1a O 25.2700 -18.3400
30 C1a C 26.4600 -19.0400
31 C1a C 26.4600 -21.8400
32 P1b P 30.3100 -20.4400
33 O1c O 31.7100 -20.4400
34 O1c O 30.3100 -21.8400
35 C1y C 23.8000 -15.4700
36 C1y C 25.2000 -15.4700
37 C1y C 25.6200 -14.1400
38 O2x O 24.5000 -13.3000
39 C1y C 23.3800 -14.1400
40 C1b C 26.9500 -13.7200
41 O1a O 22.9600 -16.5900
42 O2b O 26.0400 -16.5900
43 P1b P 27.4400 -16.5900
44 O1c O 27.4400 -15.1900
45 O1c O 28.8400 -16.5900
46 O1c O 27.4400 -17.9900
47 C8y C 19.2500 -12.3200
48 C8y C 19.2500 -13.7200
49 N4y N 21.7000 -13.7200
50 C8x C 21.7000 -12.3200
51 N5x N 20.4400 -11.6200
52 C8y C 18.0600 -11.6200
53 N5x N 16.8000 -12.3200
54 C8x C 16.8000 -13.7200
55 N5x N 18.0600 -14.4200
56 N1a N 18.0600 -10.2200
57 O2b O 28.9100 -14.1400
58 P1b P 30.3100 -14.1400
59 O1c O 30.3100 -12.7400
60 O1c O 31.7100 -14.1400
61 O2c O 30.3100 -17.3600
BOND 65
1 1 2 1
2 2 3 1
3 2 4 2
4 3 5 2
5 5 6 1
6 6 7 2
7 7 8 1
8 8 9 1
9 9 10 2
10 6 10 1
11 9 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 10 14 1
16 1 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 25 26 1
28 18 27 2
29 22 28 2
30 23 29 1 #Down
31 24 30 1
32 24 31 1
33 26 32 1
34 32 33 2
35 32 34 1
36 35 36 1
37 36 37 1
38 37 38 1
39 38 39 1
40 35 39 1
41 37 40 1 #Down
42 35 41 1 #Up
43 36 42 1 #Up
44 42 43 1
45 43 44 1
46 43 45 1
47 43 46 2
48 47 48 2
49 48 49 1
50 39 49 1 #Down
51 49 50 1
52 50 51 2
53 47 51 1
54 47 52 1
55 52 53 2
56 53 54 1
57 54 55 2
58 48 55 1
59 52 56 1
60 40 57 1
61 57 58 1
62 58 59 1
63 58 60 2
64 58 61 1
65 32 61 1
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