ATOM 30
1 C1y C 25.6200 -20.9300
2 N4y N 26.2500 -19.2500
3 O2x O 24.4300 -20.3000
4 C2x C 25.6200 -22.3300
5 C8y C 27.4400 -18.5500
6 C8x C 25.0600 -18.5500
7 C1y C 23.2400 -20.9300
8 C2x C 24.4300 -23.0300
9 N4x N 27.4400 -17.1500
10 O5x O 28.5600 -19.1800
11 C8x C 25.0600 -17.1500
12 C1y C 23.2400 -22.3300
13 C6a C 22.4700 -19.9500
14 C8y C 26.2500 -16.4500
15 O6a O 22.4700 -18.5500
16 O6a O 21.0000 -19.4600
17 O5x O 26.2500 -15.1200
18 N1b N 22.0500 -23.0300
19 C5a C 20.7900 -22.3300
20 C1b C 19.5300 -23.0300
21 C1c C 18.3400 -22.3300
22 C1b C 17.0800 -23.0300
23 O5a O 20.7900 -21.2800
24 C1b C 15.8200 -22.3300
25 N1a N 18.3400 -20.8600
26 N1c N 14.6300 -23.0300
27 C2c C 13.3700 -22.3300
28 N1a N 12.1100 -23.0300
29 C1a C 14.6300 -24.4300
30 N2a N 13.3700 -20.8600
BOND 31
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 2
8 5 9 1
9 5 10 2
10 6 11 2
11 7 12 1
12 7 13 1 #Up
13 9 14 1
14 13 15 1
15 13 16 2
16 14 17 2
17 8 12 1
18 11 14 1
19 12 18 1 #Down
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 19 23 2
25 22 24 1
26 21 25 1
27 24 26 1
28 26 27 1
29 27 28 1
30 26 29 1
31 27 30 2
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