ATOM 21
1 C8y C 25.4800 -16.8700
2 C8y C 25.4800 -18.3400
3 C8y C 26.6700 -16.1700
4 N5x N 24.2900 -16.3800
5 N4y N 24.2200 -18.7600
6 N5x N 26.6700 -19.1100
7 N1b N 26.6700 -14.8400
8 N5x N 27.9300 -16.9400
9 C8x C 23.4500 -17.5000
10 C1y C 23.1000 -19.6700
11 C8y C 27.9300 -18.4100
12 C1y C 27.9300 -14.1400
13 C1x C 21.9100 -18.9000
14 C2x C 22.6800 -21.0000
15 N1a N 29.1200 -19.1800
16 C1x C 29.3300 -14.2100
17 C1x C 28.6300 -12.9500
18 C1y C 20.8600 -19.6700
19 C2x C 21.3500 -21.0000
20 C1b C 19.5300 -19.3200
21 O1a O 18.4800 -20.1600
BOND 24
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 10 5 1 #Up
10 6 11 2
11 7 12 1
12 10 13 1
13 10 14 1
14 11 15 1
15 12 16 1
16 12 17 1
17 13 18 1
18 14 19 2
19 18 20 1 #Up
20 20 21 1
21 5 9 1
22 8 11 1
23 16 17 1
24 18 19 1
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