ATOM 18
1 C1y C 13.7900 -22.8900
2 C1y C 14.2100 -24.2200
3 C1y C 15.6100 -24.2200
4 C1y C 16.0300 -22.8900
5 O2x O 14.9100 -22.0500
6 C1b C 12.6000 -22.1900
7 O1a O 11.4100 -22.8900
8 C8y C 17.2200 -22.1900
9 N5x N 17.6400 -20.8600
10 N4x N 19.0400 -20.8600
11 C8y C 19.4600 -22.1900
12 C8y C 18.3400 -23.0300
13 O1a O 13.3700 -25.3400
14 O1a O 16.4500 -25.3400
15 C5a C 20.6500 -22.8900
16 N1a N 21.8400 -22.1900
17 O5a O 20.6500 -24.2900
18 O1a O 18.3400 -24.4300
BOND 19
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 1 6 1 #Up
7 6 7 1
8 4 8 1 #Up
9 8 9 2
10 9 10 1
11 10 11 1
12 11 12 2
13 12 8 1
14 2 13 1 #Down
15 3 14 1 #Down
16 11 15 1
17 15 16 1
18 15 17 2
19 12 18 1
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