ATOM 51
1 C1y C 18.3400 -23.0300
2 C1y C 19.7400 -23.0300
3 C1y C 20.1600 -21.7000
4 C1y C 19.0400 -20.8600
5 O2x O 17.9200 -21.7000
6 O2b O 20.7200 -24.0100
7 C1b C 17.1500 -23.7300
8 R R 18.3400 -19.6700
9 O2b O 15.7500 -23.7300
10 P1b P 14.3500 -23.7300
11 O1c O 14.3500 -25.1300
12 O1c O 14.3500 -22.3300
13 O1c O 12.9500 -23.7300
14 C1y C 27.6500 -23.3100
15 C1y C 29.0500 -23.3100
16 C1y C 29.4700 -21.9800
17 C1y C 28.3500 -21.1400
18 O2x O 27.2300 -21.9800
19 O2b O 29.8200 -24.1500
20 C1b C 26.4600 -24.0100
21 O2b O 25.0600 -24.0100
22 P1b P 23.6600 -24.0100
23 O1c O 23.6600 -25.4100
24 O1c O 23.6600 -22.6100
25 C1y C 36.9600 -23.4500
26 C1y C 38.3600 -23.4500
27 C1y C 38.7800 -22.1200
28 C1y C 37.6600 -21.2800
29 O2x O 36.5400 -22.1200
30 O1a O 39.3400 -24.4300
31 C1b C 35.7700 -24.1500
32 R R 36.9600 -20.0900
33 O2b O 34.3700 -24.1500
34 P1b P 32.9700 -24.1500
35 O1c O 32.9700 -25.5500
36 O1c O 32.9700 -22.7500
37 C8y C 27.9300 -17.9900
38 C8y C 27.9300 -19.3900
39 N5x N 26.7400 -20.0900
40 C8y C 25.4800 -19.3900
41 N4x N 25.4800 -17.9900
42 C8y C 26.7400 -17.2900
43 N4y N 29.2600 -19.8100
44 C8x C 30.1000 -18.6900
45 N5x N 29.2600 -17.5700
46 N1a N 24.2900 -20.0900
47 O5x O 26.7400 -15.8900
48 O1a O 21.1499 -20.7101
49 O2a O 30.4599 -20.9201
50 O1a O 39.7699 -21.1301
51 C1a C 30.5422 -19.7078
BOND 55
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 37 38 2
40 38 39 1
41 39 40 2
42 40 41 1
43 41 42 1
44 37 42 1
45 38 43 1
46 43 44 1
47 44 45 2
48 37 45 1
49 40 46 1
50 42 47 2
51 17 43 1 #Up
52 3 48 1 #Down
53 16 49 1 #Down
54 27 50 1 #Down
55 49 51 1
BRACKET 1 14.0000 -26.3900 14.0000 -19.0400
1 22.1200 -19.0400 22.1200 -26.3900
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 12 49
REPEAT 1
2 32.6200 -26.8100 32.6200 -19.4600
2 40.7400 -19.4600 40.7400 -26.8100
2 n
ORIGINAL 2 25 26 27 28 29 30 31 32 33 34 35 36 51
REPEAT 2
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