ATOM 43
1 C8y C 24.5000 -15.9600
2 N5x N 23.3100 -15.2600
3 C8x C 22.0500 -15.9600
4 C8y C 22.0500 -17.3600
5 C8x C 23.3100 -18.0600
6 C8x C 24.5000 -17.3600
7 N5x N 25.6900 -18.0600
8 C8y C 26.9500 -17.3600
9 N1c N 26.9500 -15.9600
10 O2a O 29.3300 -20.1600
11 C1b C 29.3300 -21.5600
12 C1b C 30.5200 -22.2600
13 O1a O 31.7100 -21.5600
14 C8x C 31.7100 -20.1600
15 C8x C 30.5200 -19.4600
16 C8y C 24.5000 -20.1600
17 C8x C 23.3100 -19.4600
18 C8x C 22.0500 -20.1600
19 N5x N 22.0500 -21.5600
20 C8y C 23.3100 -22.2600
21 C8x C 24.5000 -21.5600
22 C8y C 25.6900 -19.4600
23 N5x N 26.8800 -20.1600
24 C8y C 30.5200 -18.0600
25 C8x C 32.9000 -19.4600
26 C8x C 32.9000 -18.0600
27 C8y C 31.7100 -17.3600
28 C8y C 28.1400 -18.0600
29 C8y C 28.1400 -19.4600
30 O2a O 29.3300 -17.3600
31 O2a O 31.7100 -15.9600
32 C1a C 20.8600 -18.0600
33 O3c O 26.8100 -14.4200
34 C1a C 32.9700 -15.2600
35 S4a S 25.6900 -15.2600
36 O3c O 24.3600 -14.4200
37 C8y C 23.3272 -23.6599
38 N5x N 22.1938 -24.5050
39 N5x N 22.6473 -25.8442
40 N5x N 24.0611 -25.8267
41 N4y N 24.4813 -24.4767
42 Z Na 28.1566 -15.2500
43 Z Na 25.8167 -24.0242
BOND 47
1 19 20 2
2 20 21 1
3 21 16 2
4 2 3 2
5 3 4 1
6 22 16 1
7 23 22 2
8 4 5 2
9 5 6 1
10 6 1 2
11 24 15 1
12 14 25 1
13 25 26 2
14 26 27 1
15 27 24 2
16 10 11 1
17 11 12 1
18 12 13 1
19 28 29 2
20 29 10 1
21 24 30 1
22 30 28 1
23 7 22 1
24 23 29 1
25 28 8 1
26 14 15 2
27 27 31 1
28 4 32 1
29 1 2 1
30 7 8 2
31 8 9 1
32 9 35 1
33 35 33 2
34 35 1 1
35 31 34 1
36 16 17 1
37 17 18 2
38 35 36 2
39 18 19 1
40 20 37 1
41 38 39 1
42 39 40 2
43 40 41 1
44 37 41 1
45 37 38 2
46 9 42 1
47 41 43 1
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