ATOM 36
1 C8y C 25.1300 -18.9700
2 C8x C 25.1300 -20.3700
3 C8x C 26.3900 -21.0700
4 C8x C 27.5800 -20.3700
5 C8x C 27.5800 -18.9700
6 C8x C 26.3200 -18.2700
7 C1y C 20.3000 -20.3700
8 C1x C 21.4900 -21.0700
9 C1x C 22.7500 -20.3700
10 N1y N 22.7500 -18.9700
11 C1x C 21.4900 -18.2700
12 C1x C 20.3000 -18.9700
13 C8y C 15.4700 -20.3700
14 C5a C 16.6600 -21.0700
15 C1b C 17.8500 -20.3700
16 C1b C 19.1100 -21.0700
17 C1b C 23.9400 -18.2700
18 O5a O 16.6600 -22.4700
19 C8x C 15.4700 -18.9700
20 C8x C 14.2800 -18.2700
21 C8y C 13.0900 -18.9700
22 C8y C 13.0900 -20.3700
23 C8x C 14.2800 -21.0700
24 C1x C 11.9700 -18.0600
25 C1x C 10.6400 -18.4100
26 C1x C 10.0100 -19.6700
27 C1x C 10.6400 -20.9300
28 N1x N 11.9700 -21.2100
29 O6a O 31.3600 -20.3700
30 C6a C 32.5500 -19.6700
31 C2b C 33.8100 -20.3700
32 C2b C 35.0000 -19.6700
33 C6a C 36.1900 -20.3700
34 O6a O 37.4500 -19.6700
35 O6a O 32.5500 -18.2700
36 O6a O 36.1900 -21.7700
BOND 38
1 9 10 1
2 10 11 1
3 13 14 1
4 11 12 1
5 14 15 1
6 12 7 1
7 15 16 1
8 16 7 1
9 5 6 2
10 10 17 1
11 17 1 1
12 14 18 2
13 6 1 1
14 1 2 2
15 2 3 1
16 3 4 2
17 4 5 1
18 7 8 1
19 8 9 1
20 13 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 13 23 1
26 25 26 1
27 26 27 1
28 24 25 1
29 22 28 1
30 21 24 1
31 27 28 1
32 29 30 1
33 30 31 1
34 31 32 2
35 32 33 1
36 33 34 1
37 30 35 2
38 33 36 2
BRACKET 1 29.8200 -23.3800 29.8200 -16.6600
1 39.2000 -16.6600 39.2000 -23.3800
1 x
ORIGINAL 1 29 30 31 32 33 34 35 36
REPEAT 1
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