ATOM 24
1 C1y C 28.5549 -20.2651
2 C1y C 29.6856 -20.9878
3 C8y C 27.3196 -20.9412
4 C1y C 28.5257 -18.8781
5 C2y C 31.0027 -20.5449
6 N1y N 29.6973 -22.3863
7 C8y C 27.2903 -22.3340
8 C8x C 26.1305 -20.2243
9 C1y C 29.8254 -18.2195
10 N1x N 27.4068 -18.1378
11 C2x C 30.9968 -18.9481
12 C1y C 31.8419 -21.6579
13 C1x C 28.4850 -23.0567
14 C1x C 31.0318 -22.8002
15 C8x C 26.0839 -23.0160
16 C8y C 24.8367 -20.9061
17 C1x C 29.8020 -16.8267
18 C1x C 27.4536 -16.7451
19 O1a O 33.2348 -21.6112
20 C8y C 24.8191 -22.2989
21 O2x O 23.5838 -20.4574
22 C1x C 28.6832 -16.0866
23 O2x O 23.5547 -22.7127
24 C1x C 22.7503 -21.5705
BOND 29
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 2
11 5 12 1
12 6 13 1
13 6 14 1
14 7 15 1
15 8 16 2
16 9 17 1
17 10 18 1
18 12 19 1
19 15 20 2
20 16 21 1
21 17 22 1
22 20 23 1
23 21 24 1
24 7 13 1
25 9 11 1
26 12 14 1
27 16 20 1
28 18 22 1
29 23 24 1
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