ATOM 43
1 C2c C 4.3400 -14.7000
2 N1b N 5.5300 -15.4000
3 N1a N 3.1500 -15.4000
4 N2a N 4.3400 -13.3000
5 C1b C 6.7200 -14.7000
6 C1b C 7.9100 -15.4000
7 C1b C 9.1000 -14.7000
8 C1c C 10.2900 -15.4000
9 C5a C 11.4800 -14.7000
10 N1b N 12.6700 -15.4000
11 C1b C 13.8600 -14.7000
12 O5a O 11.4800 -13.3000
13 N1b N 10.2900 -16.8000
14 C5a C 9.1000 -17.5000
15 C1b C 7.9100 -16.8000
16 N1a N 6.7200 -17.5000
17 O5a O 9.1000 -18.9000
18 C5a C 15.0500 -15.4000
19 N1b N 16.2400 -14.7000
20 O5a O 15.0500 -16.8000
21 C1c C 17.4300 -15.4000
22 C1b C 18.6200 -14.7000
23 S4a S 19.8100 -15.4000
24 C5a C 17.4300 -16.8000
25 O5a O 18.6200 -17.5000
26 N1b N 16.2400 -17.5000
27 C1c C 16.2400 -18.9000
28 C1c C 15.0500 -19.6000
29 C1a C 13.8600 -18.9000
30 C5a C 17.4300 -19.6000
31 O5a O 18.6200 -18.9000
32 N1y N 17.4300 -21.0000
33 C1x C 16.3100 -21.8400
34 C1x C 16.7300 -23.1700
35 C1x C 18.1300 -23.1700
36 C1y C 18.5500 -21.8400
37 O1a O 15.0500 -21.0000
38 C6a C 19.7400 -21.1400
39 O6a O 20.9300 -21.8400
40 O6a O 19.7400 -19.7400
41 O1d O 21.0000 -14.7000
42 O1d O 19.8100 -16.8000
43 O1d O 21.0000 -16.1000
BOND 43
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 9 12 2
12 8 13 1 #Up
13 13 14 1
14 14 15 1
15 15 16 1
16 14 17 2
17 11 18 1
18 18 19 1
19 18 20 2
20 19 21 1
21 21 22 1
22 22 23 1
23 21 24 1 #Up
24 24 25 2
25 24 26 1
26 27 26 1 #Down
27 27 28 1
28 28 29 1
29 27 30 1
30 30 31 2
31 30 32 1
32 32 33 1
33 33 34 1
34 34 35 1
35 35 36 1
36 32 36 1
37 28 37 1 #Down
38 38 39 1
39 36 38 1 #Down
40 38 40 2
41 23 41 2
42 23 42 2
43 23 43 1
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