ATOM 18
1 N4y N 26.3900 -17.7100
2 C1y C 24.9900 -18.2000
3 C8y C 27.6500 -17.3600
4 C8x C 25.6200 -16.6600
5 O2x O 23.8700 -17.4300
6 C1y C 24.5700 -19.4600
7 C8y C 27.6500 -15.9600
8 N5x N 28.8400 -17.9900
9 N5x N 26.3900 -15.5400
10 C1y C 22.8200 -18.2000
11 C1y C 23.2400 -19.4600
12 O1a O 25.4100 -20.5800
13 C8x C 28.8400 -15.3300
14 C8x C 29.9600 -17.3600
15 C1b C 21.5600 -17.7800
16 O1a O 22.4700 -20.5800
17 N5x N 29.9600 -15.9600
18 O1a O 21.2800 -16.5200
BOND 20
1 2 1 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 1
11 6 12 1 #Down
12 7 13 1
13 8 14 2
14 10 15 1 #Up
15 11 16 1 #Down
16 13 17 2
17 15 18 1
18 7 9 1
19 10 11 1
20 14 17 1
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