ATOM 35
1 C8x C 19.9500 -20.9300
2 C8y C 19.9500 -22.3300
3 C8x C 21.1400 -23.0300
4 C8x C 22.4000 -22.3300
5 C8y C 22.4000 -20.9300
6 C8x C 21.1400 -20.2300
7 C8y C 23.5900 -20.2300
8 O1a O 18.7600 -23.0300
9 N5x N 24.7800 -20.9300
10 C8y C 26.0400 -20.2300
11 C8y C 26.0400 -18.8300
12 N4y N 24.7800 -18.1300
13 C8x C 23.5900 -18.8300
14 N5x N 27.0200 -17.8500
15 C8y C 26.4600 -16.5900
16 C8y C 25.1300 -16.7300
17 C1b C 27.2300 -20.9300
18 C8y C 28.4900 -20.2300
19 C8x C 29.6800 -20.9300
20 C8x C 30.8700 -20.2300
21 C8x C 30.8700 -18.8300
22 C8x C 29.6800 -18.1300
23 C8x C 28.4900 -18.8300
24 O2a O 24.1500 -15.6800
25 C1b C 27.1600 -15.4000
26 C8y C 28.5600 -15.4000
27 C8x C 29.2600 -16.5900
28 C8x C 30.6600 -16.5900
29 C8x C 31.3600 -15.4000
30 C8x C 30.6600 -14.2100
31 C8x C 29.2600 -14.2100
32 S4a S 22.7500 -15.6800
33 O1d O 21.3500 -15.6800
34 O1d O 22.7500 -14.2800
35 O1d O 22.7500 -17.0800
BOND 39
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 2 8 1
9 7 9 1
10 9 10 2
11 10 11 1
12 11 12 1
13 12 13 1
14 7 13 2
15 11 14 2
16 14 15 1
17 15 16 2
18 12 16 1
19 10 17 1
20 17 18 1
21 18 19 2
22 19 20 1
23 20 21 2
24 21 22 1
25 22 23 2
26 18 23 1
27 16 24 1
28 15 25 1
29 25 26 1
30 26 27 2
31 27 28 1
32 28 29 2
33 29 30 1
34 30 31 2
35 26 31 1
36 24 32 1
37 32 33 1
38 32 34 2
39 32 35 2
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