ATOM 58
1 C1y C 18.0600 -13.9300
2 C1y C 18.0600 -15.3300
3 O2x O 16.8700 -13.2300
4 O2b O 19.1800 -13.2300
5 C1y C 16.8700 -16.0300
6 N1b N 19.3200 -16.5900
7 C1y C 15.6800 -13.9300
8 P1b P 20.5100 -13.2300
9 C1y C 15.6800 -15.3300
10 O2a O 16.8700 -17.3600
11 C5a C 19.3200 -17.9200
12 C1b C 14.4900 -13.2300
13 O2c O 21.9100 -13.2300
14 O1c O 20.5100 -11.9000
15 O1c O 20.5100 -14.6300
16 O1a O 14.4900 -15.9600
17 C1c C 15.6800 -18.0600
18 C1a C 20.5100 -18.5500
19 O5a O 18.2000 -18.5500
20 O1a O 14.4900 -11.9000
21 P1b P 23.2400 -13.2300
22 C5a C 15.6800 -19.3200
23 C1a C 14.4900 -17.3600
24 O2b O 24.6400 -13.2300
25 O1c O 23.2400 -11.9000
26 O1c O 23.2400 -14.6300
27 N1b N 14.2100 -20.5100
28 O5a O 16.8700 -20.0200
29 C1b C 24.9200 -14.5600
30 C1c C 14.1400 -21.8400
31 C1y C 26.1800 -14.9800
32 C5a C 12.8800 -22.3300
33 C1a C 15.3300 -22.6100
34 O2x O 27.3000 -14.2100
35 C1y C 26.6700 -16.3100
36 N1b N 11.7600 -21.4900
37 O5a O 12.8800 -23.6600
38 C1y C 28.4200 -15.0500
39 C1y C 28.0000 -16.3100
40 O1a O 25.8300 -17.4300
41 C1c C 11.2000 -20.0900
42 N4y N 29.4700 -12.8100
43 O1a O 28.8400 -17.4300
44 C1b C 9.9400 -19.7400
45 C6a C 12.2500 -19.2500
46 C8y C 28.2800 -12.1100
47 C8x C 30.6600 -12.1100
48 C1b C 8.8900 -20.6500
49 O6a O 13.5800 -19.2500
50 O6a O 11.7600 -18.0600
51 N4x N 28.2800 -10.7800
52 O5x O 27.1600 -12.8100
53 C8x C 30.6600 -10.7800
54 C6a C 7.7000 -19.9500
55 C8y C 29.4700 -10.0800
56 O6a O 6.5800 -20.6500
57 O6a O 7.7000 -18.5500
58 O5x O 29.4700 -8.6800
BOND 60
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 1 #Up
10 6 11 1
11 7 12 1 #Up
12 8 13 1
13 8 14 1
14 8 15 2
15 9 16 1 #Down
16 10 17 1
17 11 18 1
18 11 19 2
19 12 20 1
20 13 21 1
21 17 22 1
22 17 23 1 #Up
23 21 24 1
24 21 25 1
25 21 26 2
26 22 27 1
27 22 28 2
28 24 29 1
29 30 27 1 #Up
30 31 29 1 #Up
31 30 32 1
32 30 33 1
33 31 34 1
34 31 35 1
35 32 36 1
36 32 37 2
37 34 38 1
38 35 39 1
39 35 40 1 #Down
40 41 36 1 #Up
41 38 42 1 #Up
42 39 43 1 #Down
43 41 44 1
44 41 45 1
45 42 46 1
46 42 47 1
47 44 48 1
48 45 49 1
49 45 50 2
50 46 51 1
51 46 52 2
52 47 53 2
53 48 54 1
54 51 55 1
55 54 56 1
56 54 57 2
57 55 58 2
58 7 9 1
59 38 39 1
60 53 55 1
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