ATOM 31
1 Z Na 28.9497 -23.6697 #+
2 C1y C 30.2971 -20.3672
3 C1x C 30.7144 -21.7032
4 C1x C 32.1155 -21.7188
5 C1x C 32.5633 -20.3912
6 O2x O 31.4390 -19.5551
7 C1y C 26.7080 -18.2757
8 N1y N 26.7080 -19.6767
9 C2y C 27.8990 -20.3772
10 C2y C 29.0899 -19.6767
11 C1x C 29.0899 -18.2757
12 S2x S 27.8990 -17.5751
13 C1y C 25.3071 -18.2757
14 C5x C 25.3071 -19.6767
15 N1b N 24.0460 -17.5751
16 C5a C 22.8552 -18.2757
17 O5a O 22.8552 -19.6767
18 O5x O 24.0460 -20.3772
19 C2c C 21.6642 -17.5751
20 C8y C 20.4033 -18.2757
21 C8x C 19.3525 -17.4349
22 S2x S 18.1616 -18.2056
23 C8y C 18.5820 -19.6067
24 N5x N 19.9829 -19.6067
25 N2b N 21.6642 -16.1740
26 C6a C 27.8990 -21.7783
27 O6a O 29.0899 -22.4789 #-
28 O6a O 26.6381 -22.4789
29 N1a N 17.7413 -20.7274
30 O2a O 22.8551 -15.4924
31 C1a C 22.8551 -14.0924
BOND 33
1 2 3 1
2 3 4 1
3 4 5 1
4 5 6 1
5 2 6 1
6 7 8 1
7 8 9 1
8 9 10 2
9 10 11 1
10 11 12 1
11 7 12 1
12 7 13 1
13 13 14 1
14 8 14 1
15 13 15 1 #Up
16 15 16 1
17 16 17 2
18 14 18 2
19 16 19 1
20 19 20 1
21 20 21 2
22 21 22 1
23 22 23 1
24 23 24 2
25 20 24 1
26 19 25 2
27 9 26 1
28 26 27 1
29 26 28 2
30 23 29 1
31 2 10 1 #Up
32 25 30 1
33 30 31 1
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