ATOM 32
1 C1y C 19.0118 -16.1971
2 N1y N 19.0118 -17.5496
3 C2y C 20.1507 -18.2614
4 C2y C 21.3608 -17.5496
5 C1x C 21.3608 -16.1971
6 S2x S 20.1507 -15.4852
7 C1y C 17.5880 -16.1971
8 C5x C 17.5880 -17.5496
9 N1b N 16.3068 -15.4852
10 C5a C 15.1678 -16.1971
11 O5a O 15.1678 -17.5496
12 O5x O 16.3068 -18.2614
13 C2c C 13.9576 -15.4852
14 C1b C 22.6422 -18.2614
15 C8y C 12.6763 -16.1971
16 N4y N 23.7811 -17.5496
17 C8x C 11.6797 -15.3429
18 S2x S 10.4695 -16.1258
19 C8y C 10.8966 -17.4783
20 N5x N 12.3204 -17.4783
21 N2b N 13.9576 -14.0615
22 N1a N 10.0425 -18.6173
23 N5x N 24.9201 -18.3325
24 C8y C 26.0590 -17.5496
25 N5x N 25.6318 -16.1971
26 N5x N 24.2082 -16.1971
27 C1a C 27.2691 -18.1902
28 O2a O 15.1678 -13.3496
29 C1a C 15.1678 -11.9260
30 C6a C 20.1316 -19.6815
31 O6a O 18.9110 -20.3651
32 O6a O 21.3839 -20.4272
BOND 35
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 1
8 7 8 1
9 2 8 1
10 7 9 1 #Up
11 9 10 1
12 10 11 2
13 8 12 2
14 10 13 1
15 4 14 1
16 13 15 1
17 14 16 1
18 15 17 2
19 17 18 1
20 18 19 1
21 19 20 2
22 15 20 1
23 13 21 2
24 19 22 1
25 16 23 1
26 23 24 2
27 24 25 1
28 25 26 2
29 16 26 1
30 24 27 1
31 21 28 1
32 28 29 1
33 3 30 1
34 30 31 2
35 30 32 1
| 
