ATOM 17
1 C1y C 24.3600 -22.3300
2 C1x C 25.7600 -22.3300
3 C1z C 25.0600 -19.3200
4 C8y C 23.8000 -19.8800
5 C8y C 23.5200 -21.2100
6 C8x C 22.1900 -21.6300
7 C8x C 21.2100 -20.6500
8 C8x C 21.4900 -19.3200
9 C8x C 22.8200 -18.9700
10 C8y C 26.6000 -21.2800
11 C8y C 26.3200 -19.8800
12 C8x C 27.3700 -18.9700
13 C8x C 28.6300 -19.3900
14 C8x C 28.9800 -20.7200
15 C8x C 27.9300 -21.7000
16 N1x N 25.0600 -20.6500
17 C1a C 25.0600 -17.9200
BOND 20
1 6 7 2
2 7 8 1
3 8 9 2
4 9 4 1
5 1 2 1
6 2 10 1
7 1 5 1
8 11 3 1
9 4 3 1
10 10 11 2
11 11 12 1
12 12 13 2
13 13 14 1
14 14 15 2
15 15 10 1
16 4 5 2
17 3 16 1 #Up
18 1 16 1 #Up
19 5 6 1
20 3 17 1
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