ATOM 54
1 C1b C 8.7500 -20.5800
2 C5a C 10.0100 -19.8800
3 S2a S 11.2000 -20.5800
4 C1b C 12.3900 -19.8800
5 C1b C 13.6500 -20.5800
6 N1b N 14.8400 -19.8800
7 C5a C 16.0300 -20.5800
8 C1b C 17.2900 -19.8800
9 C1b C 18.4800 -20.5800
10 N1b N 19.6700 -19.8800
11 C5a C 20.9300 -20.5800
12 C1c C 22.1200 -19.8800
13 C1d C 23.3100 -20.5800
14 C1b C 24.5000 -19.8800
15 O2b O 25.7600 -20.5800
16 O5a O 10.0100 -18.4800
17 O5a O 16.0300 -21.9800
18 O5a O 20.9300 -21.9800
19 O1a O 22.1200 -18.4800
20 C1a C 23.3100 -19.1800
21 C1a C 23.3100 -21.9800
22 P1b P 27.1600 -20.5800
23 O1c O 28.5600 -20.5800
24 O1c O 27.1600 -21.9800
25 C1y C 20.6500 -15.6100
26 C1y C 22.0500 -15.6100
27 C1y C 22.4700 -14.2800
28 O2x O 21.3500 -13.4400
29 C1y C 20.2300 -14.2800
30 C1b C 23.8000 -13.8600
31 O1a O 19.8100 -16.7300
32 O2b O 22.8900 -16.7300
33 P1b P 24.2900 -16.7300
34 O1c O 24.2900 -15.3300
35 O1c O 25.6900 -16.7300
36 O1c O 24.2900 -18.1300
37 C8y C 16.1000 -12.4600
38 C8y C 16.1000 -13.8600
39 N4y N 18.5500 -13.8600
40 C8x C 18.5500 -12.4600
41 N5x N 17.2900 -11.7600
42 C8y C 14.9100 -11.7600
43 N5x N 13.6500 -12.4600
44 C8x C 13.6500 -13.8600
45 N5x N 14.9100 -14.5600
46 N1a N 14.9100 -10.3600
47 O2b O 25.7600 -14.2800
48 P1b P 27.1600 -14.2800
49 O1c O 27.1600 -12.8800
50 O1c O 28.5600 -14.2800
51 O2c O 27.1600 -17.5000
52 C2b C 7.5600 -19.8800
53 C2b C 6.1600 -19.8800
54 R R 4.9700 -20.5800
BOND 56
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 2 16 2
16 7 17 2
17 11 18 2
18 12 19 1 #Down
19 13 20 1
20 13 21 1
21 15 22 1
22 22 23 2
23 22 24 1
24 25 26 1
25 26 27 1
26 27 28 1
27 28 29 1
28 25 29 1
29 27 30 1 #Down
30 25 31 1 #Up
31 26 32 1 #Up
32 32 33 1
33 33 34 1
34 33 35 1
35 33 36 2
36 37 38 2
37 38 39 1
38 39 40 1
39 40 41 2
40 37 41 1
41 37 42 1
42 42 43 2
43 43 44 1
44 44 45 2
45 38 45 1
46 42 46 1
47 29 39 1 #Down
48 30 47 1
49 47 48 1
50 48 49 1
51 48 50 2
52 48 51 1
53 22 51 1
54 1 52 1
55 52 53 2
56 54 53 1
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