ATOM 24
1 C8y C 26.4944 -21.2795
2 N4y N 25.4361 -20.5469
3 C8y C 27.7213 -20.3782
4 N5x N 26.6281 -22.6924
5 C1y C 24.1510 -20.9596
6 C8y C 25.9070 -19.1570
7 N5x N 27.3491 -19.1629
8 C8y C 28.9715 -20.9306
9 C8y C 27.9482 -23.2798
10 C1y C 23.7265 -22.2039
11 O2x O 23.0230 -20.1165
12 N4x N 29.1285 -22.4074
13 O5x O 30.0704 -20.1108
14 N1a N 28.1051 -24.7450
15 C1y C 22.3543 -22.2039
16 O1a O 24.3778 -23.3379
17 C1y C 21.9241 -20.9015
18 O2x O 21.3658 -23.1866
19 C1x C 20.7384 -20.4013
20 P1b P 19.8541 -22.7623
21 O2x O 19.7033 -21.2616
22 O1c O 19.9124 -24.1519
23 O1c O 18.4116 -22.3438
24 X Br 25.1024 -18.0295
BOND 27
1 1 2 1
2 1 3 2
3 1 4 1
4 5 2 1 #Up
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 5 11 1
11 8 12 1
12 8 13 2
13 9 14 1
14 10 15 1
15 10 16 1 #Down
16 11 17 1
17 15 18 1 #Down
18 17 19 1 #Up
19 18 20 1
20 19 21 1
21 20 22 1
22 20 23 2
23 6 7 2
24 9 12 1
25 15 17 1
26 20 21 1
27 6 24 1
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