ATOM 46
1 N2b N 29.9600 -24.2900 #+
2 O3a O 31.2200 -24.9900 #-
3 O3a O 28.7700 -24.9900 #-
4 O3a O 29.9600 -22.8900
5 C8y C 8.3300 -21.2800
6 N5x N 8.3300 -19.8800
7 C8y C 9.5200 -19.1100
8 C8y C 10.7100 -19.8800
9 C8x C 10.7100 -21.2800
10 N5x N 9.5200 -21.9800
11 C1b C 11.9700 -19.1100
12 N1c N 13.1600 -19.8800
13 C2c C 13.1600 -21.2800
14 C1a C 7.0700 -21.9800
15 N1a N 9.5200 -17.7100 #+
16 C1a C 11.9700 -21.9800
17 C4a C 14.3500 -19.1100
18 C2c C 14.3500 -21.9800
19 O4a O 15.5400 -19.8800
20 S3a S 15.5400 -21.2800
21 C1b C 14.3500 -23.3800
22 C1b C 13.1600 -24.0800
23 O1a O 11.9700 -23.3800
24 S3a S 16.8000 -21.9800
25 C2c C 17.9900 -21.2800
26 C2c C 19.1800 -21.9800
27 C1b C 17.9900 -19.8800
28 C1b C 19.1800 -19.1100
29 O1a O 20.3700 -19.8800
30 C1a C 20.3700 -21.2800
31 N1c N 19.1800 -23.3800
32 C4a C 17.9900 -24.0800
33 C1b C 20.3700 -24.0800
34 O4a O 16.8000 -23.3800
35 C8y C 21.5600 -23.3800
36 C8y C 22.7500 -24.0800
37 N5x N 24.0100 -23.3800
38 C8y C 24.0100 -21.9800
39 N5x N 22.8200 -21.2800
40 C8x C 21.5600 -21.9800
41 C1a C 25.2000 -21.2800
42 N1a N 22.7500 -25.4800 #+
43 N2b N 29.9600 -24.2900 #+
44 O3a O 31.2200 -24.9900 #-
45 O3a O 28.7700 -24.9900 #-
46 O3a O 29.9600 -22.8900
BOND 45
1 5 6 1
2 11 12 1
3 6 7 2
4 7 8 1
5 12 13 1
6 8 9 2
7 9 10 1
8 10 5 2
9 5 14 1
10 8 11 1
11 7 15 1
12 13 16 1
13 12 17 1
14 13 18 2
15 17 19 2
16 18 20 1
17 18 21 1
18 21 22 1
19 22 23 1
20 20 24 1
21 24 25 1
22 25 26 2
23 25 27 1
24 27 28 1
25 28 29 1
26 26 30 1
27 26 31 1
28 31 32 1
29 31 33 1
30 32 34 2
31 33 35 1
32 35 36 1
33 36 37 2
34 37 38 1
35 38 39 2
36 39 40 1
37 35 40 2
38 38 41 1
39 36 42 1
40 1 2 1
41 1 3 1
42 1 4 2
43 43 44 1
44 43 45 1
45 43 46 2
BRACKET 1 27.8600 -25.7600 27.8600 -22.4000
1 32.2000 -22.4000 32.2000 -25.7600
1 2
ORIGINAL 1 1 2 3 4
REPEAT 1 43 44 45 46
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