ATOM 43
1 C1y C 25.0144 -17.4637
2 N4y N 26.0799 -15.2570
3 O2x O 23.9024 -16.6545
4 C1y C 24.6185 -18.7387
5 C8y C 24.9096 -14.5466
6 C8x C 27.2794 -14.5466
7 C1y C 22.8078 -17.4404
8 C1y C 23.2561 -18.7387
9 O1a O 25.4220 -19.8450
10 N4x N 24.9096 -13.1666
11 O5x O 23.7219 -15.2220
12 C8x C 27.2794 -13.1666
13 C1b C 21.5152 -17.0328
14 O1a O 22.4527 -19.8450
15 C8y C 26.0858 -12.4912
16 O2b O 21.2241 -15.6995
17 O5x O 26.0858 -11.1231
18 P1b P 19.8558 -15.6995
19 O2c O 18.4933 -15.6995
20 O1c O 19.8558 -14.3312
21 O1c O 19.8500 -17.0561
22 P1b P 17.1367 -15.6995
23 O2b O 15.7626 -15.6937
24 O1c O 17.1367 -14.3312
25 O1c O 17.1367 -17.0561
26 C1y C 14.5807 -16.3632
27 C1y C 14.5807 -17.7373
28 O2x O 13.3930 -15.6937
29 C1y C 13.3930 -18.4127
30 N1b N 16.0188 -18.8785
31 C1y C 12.2111 -16.3632
32 C1y C 12.2111 -17.7373
33 O2b O 13.3930 -19.7751
34 C5a C 17.2723 -20.1012
35 C1b C 11.0523 -15.6937
36 O1a O 11.0523 -18.4127
37 O1a O 10.0102 -16.5670
38 P1b P 13.3930 -21.1751
39 O1c O 11.9930 -21.1751
40 O1c O 13.3930 -22.5751
41 C1a C 18.6393 -19.7167
42 O5a O 16.9307 -21.4431
43 O1c O 14.7930 -21.1751
BOND 45
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 4 9 1 #Down
9 5 10 1
10 5 11 2
11 6 12 2
12 7 13 1 #Up
13 8 14 1 #Down
14 10 15 1
15 13 16 1
16 15 17 2
17 16 18 1
18 18 19 1
19 18 20 1
20 18 21 2
21 19 22 1
22 22 23 1
23 22 24 1
24 22 25 2
25 26 23 1 #Down
26 26 27 1
27 26 28 1
28 27 29 1
29 27 30 1 #Down
30 28 31 1
31 29 32 1
32 29 33 1 #Up
33 30 34 1
34 31 35 1 #Up
35 32 36 1 #Down
36 35 37 1
37 7 8 1
38 12 15 1
39 31 32 1
40 33 38 1
41 38 39 1
42 38 40 2
43 34 41 1
44 34 42 2
45 38 43 1
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