ATOM 35
1 C1y C 24.9537 -19.5120
2 N1y N 24.9537 -20.9041
3 C2y C 26.1594 -21.6001
4 C2y C 27.3650 -20.9041
5 C1x C 27.3650 -19.5120
6 S2x S 26.1594 -18.8159
7 C1y C 23.5614 -19.5120
8 C5x C 23.5614 -20.9041
9 N1b N 22.3560 -18.8159
10 C5a C 21.1503 -19.5120
11 O5a O 21.1503 -20.9041
12 O5x O 22.3560 -21.6001
13 C2c C 19.9446 -18.8159
14 C1b C 28.5892 -21.6113
15 C8y C 18.7197 -19.5235
16 C8x C 17.5869 -18.6913
17 S2x S 16.4406 -19.5101
18 C8y C 16.8651 -20.9232
19 N5x N 18.2735 -20.9347
20 N2b N 19.9445 -17.4024
21 C6a C 26.1594 -23.0090
22 O6a O 27.3757 -23.7112 #-
23 O6a O 24.9448 -23.7104
24 S2a S 29.7630 -20.9343
25 C5a C 30.9662 -21.6297
26 C8y C 32.1514 -20.9463
27 C8x C 32.1514 -19.5454
28 O2x O 33.4836 -21.3792
29 C8x C 34.3069 -20.2458
30 C8x C 33.4836 -19.1126
31 N1a N 16.0597 -22.0540
32 O5a O 30.9659 -23.0147
33 O2a O 21.1487 -16.7072
34 C1a C 21.1487 -15.3072
35 Z Na 28.8394 -23.6595 #+
BOND 37
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 15 16 2
18 16 17 1
19 17 18 1
20 18 19 2
21 15 19 1
22 13 20 2
23 3 21 1
24 21 22 1
25 21 23 2
26 14 24 1
27 24 25 1
28 25 26 1
29 26 27 2
30 26 28 1
31 28 29 1
32 29 30 2
33 27 30 1
34 18 31 1
35 25 32 2
36 20 33 1
37 33 34 1
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