ATOM 18
1 C1z C 27.5800 -21.5600
2 C2y C 28.7700 -20.8600
3 C5x C 26.3200 -20.8600
4 C5x C 27.5800 -22.9600
5 C1b C 28.7700 -22.2600
6 N1x N 25.1300 -21.5600
7 O5x O 26.3200 -19.4600
8 N1x N 26.3200 -23.6600
9 O5x O 28.7700 -23.6600
10 C1a C 30.1700 -22.2600
11 C5x C 25.1300 -22.9600
12 O5x O 23.9400 -23.6600
13 C1x C 28.7700 -19.4600
14 C1x C 29.8900 -18.5500
15 C1x C 31.2200 -18.9000
16 C1x C 31.8500 -20.1600
17 C1x C 31.2200 -21.4200
18 C2x C 29.8900 -21.7000
BOND 19
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1
5 3 6 1
6 3 7 2
7 4 8 1
8 4 9 2
9 5 10 1
10 6 11 1
11 11 12 2
12 8 11 1
13 15 16 1
14 13 2 1
15 16 17 1
16 14 15 1
17 2 18 2
18 13 14 1
19 17 18 1
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