ATOM 19
1 C1z C 30.1700 -18.0600
2 C5x C 29.6800 -19.3900
3 N2x N 28.2800 -19.3900
4 C2y C 27.8600 -18.0600
5 N1x N 29.0500 -17.2200
6 O5x O 30.5200 -20.5100
7 C8y C 26.5300 -17.6400
8 C8y C 25.4100 -18.3400
9 C8x C 24.2200 -17.6400
10 C8x C 24.2200 -16.2400
11 C8x C 25.3400 -15.5400
12 N5x N 26.5300 -16.2400
13 C6a C 25.4100 -19.7400
14 O6a O 26.6000 -20.3700
15 O6a O 24.2200 -20.4400
16 C1a C 31.1599 -16.9301
17 C1c C 31.3824 -18.7600
18 C1a C 32.5779 -18.0696
19 C1a C 31.3825 -20.1598
BOND 20
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 1 5 1
6 2 6 2
7 4 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 7 12 1
14 8 13 1
15 13 14 2
16 13 15 1
17 1 16 1
18 1 17 1
19 17 18 1
20 17 19 1
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