ATOM 56
1 C1y C 22.1900 -25.0600
2 C1y C 23.5900 -25.0600
3 C1y C 24.0100 -23.7300
4 C1y C 22.8900 -22.8900
5 O2x O 21.7700 -23.7300
6 O2b O 24.5700 -26.0400
7 C1b C 21.0000 -25.7600
8 R R 22.1900 -21.7000
9 O2b O 19.6000 -25.7600
10 P1b P 18.2000 -25.7600
11 O1c O 18.2000 -27.1600
12 O1c O 18.2000 -24.3600
13 O1c O 16.8000 -25.7600
14 C1y C 31.5000 -25.3400
15 C1y C 32.9000 -25.3400
16 C1y C 33.3200 -24.0100
17 C1y C 32.2000 -23.1700
18 O2x O 31.0800 -24.0100
19 O2b O 33.6700 -26.1800
20 C1b C 30.3100 -26.0400
21 O2b O 28.9100 -26.0400
22 P1b P 27.5100 -26.0400
23 O1c O 27.5100 -27.4400
24 O1c O 27.5100 -24.6400
25 C1y C 40.1800 -25.4800
26 C1y C 41.5800 -25.4800
27 C1y C 42.0000 -24.1500
28 C1y C 40.8800 -23.3100
29 O2x O 39.7600 -24.1500
30 O1a O 42.5600 -26.4600
31 C1b C 38.9900 -26.1800
32 R R 40.1800 -22.1200
33 O2b O 37.5900 -26.1800
34 P1b P 36.1900 -26.1800
35 O1c O 36.1900 -27.5800
36 O1c O 36.1900 -24.7800
37 O1a O 24.9900 -22.7500
38 O1a O 34.3000 -23.0300
39 O1a O 42.9800 -23.1700
40 C8y C 28.7000 -20.5800
41 C8x C 28.7000 -21.9800
42 C8x C 29.9124 -22.6800
43 N4y N 31.1249 -21.9800
44 C8y C 31.1249 -20.5800
45 N4x N 29.9124 -19.8800
46 N2b N 32.3560 -19.8690
47 N2a N 27.4876 -19.8800
48 C1b C 33.5684 -20.5690
49 C1b C 34.7809 -19.8690
50 C1b C 34.7809 -18.4690
51 C1b C 33.5684 -17.7690
52 C1c C 33.5684 -16.3690
53 C6a C 34.7809 -15.6690
54 N1a N 32.3560 -15.6690
55 O6a O 34.7809 -14.2690
56 O6a O 35.9933 -16.3690
BOND 59
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 2 6 1 #Down
7 1 7 1 #Up
8 4 8 1 #Up
9 7 9 1
10 9 10 1
11 10 11 2
12 10 12 1
13 10 13 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 14 18 1
19 15 19 1 #Down
20 14 20 1 #Up
21 20 21 1
22 21 22 1
23 22 23 2
24 22 24 1
25 22 6 1
26 25 26 1
27 26 27 1
28 27 28 1
29 28 29 1
30 25 29 1
31 26 30 1 #Down
32 25 31 1 #Up
33 28 32 1 #Up
34 31 33 1
35 33 34 1
36 34 35 2
37 34 36 1
38 34 19 1
39 3 37 1 #Down
40 16 38 1 #Down
41 27 39 1 #Down
42 40 41 1
43 41 42 2
44 42 43 1
45 43 44 1
46 44 45 1
47 40 45 1
48 17 43 1 #Up
49 44 46 2
50 40 47 2
51 46 48 1
52 48 49 1
53 49 50 1
54 50 51 1
55 51 52 1
56 52 53 1
57 52 54 1 #Down
58 53 55 2
59 53 56 1
BRACKET 1 17.8500 -28.4200 17.8500 -21.0700
1 25.9700 -21.0700 25.9700 -28.4200
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 12 38
REPEAT 1
2 35.8400 -28.8400 35.8400 -21.4900
2 43.9600 -21.4900 43.9600 -28.8400
2 n
ORIGINAL 2 25 26 27 28 29 30 31 32 33 34 35 36 40
REPEAT 2
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