ATOM 40
1 C1y C 25.0568 -17.6207
2 N4y N 26.1786 -15.3773
3 O2x O 23.9350 -16.7795
4 C1y C 24.7063 -18.8827
5 C8y C 24.9867 -14.6762
6 C8x C 27.3705 -14.6762
7 C1y C 22.8834 -17.6207
8 C1y C 23.3041 -18.8827
9 O1a O 25.4775 -20.0045
10 N4x N 24.9867 -13.3441
11 O5x O 23.7948 -15.3773
12 C8x C 27.3705 -13.3441
13 C1b C 21.6214 -17.2001
14 O1a O 22.5328 -20.0045
15 C8y C 26.1786 -12.6430
16 O2b O 21.2708 -15.7979
17 O5x O 26.1786 -11.2407
18 P1b P 19.8686 -15.7979
19 O2c O 18.5365 -15.7979
20 O1c O 19.8686 -17.2001
21 O1c O 19.8686 -14.4658
22 P1b P 17.1343 -15.7979
23 O2b O 15.8023 -15.7979
24 O1c O 17.1343 -17.2001
25 O1c O 17.1343 -14.4658
26 C1y C 14.6104 -16.4991
27 C1y C 14.6104 -17.9012
28 O2x O 13.4185 -15.7979
29 C1y C 13.4185 -18.6023
30 N1b N 15.8023 -18.6023
31 C1y C 12.2266 -16.4991
32 C1y C 12.2266 -17.9012
33 O1a O 13.4185 -19.9344
34 C5a C 11.0347 -15.7979
35 O1a O 11.0347 -18.6023
36 N1a N 9.8428 -16.4991
37 O5a O 11.0347 -14.4658
38 C5a C 15.8023 -20.2845
39 C1a C 14.5966 -20.9807
40 O5a O 17.0348 -20.9959
BOND 42
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 31 34 1 #Up
34 32 35 1 #Up
35 34 36 1
36 34 37 2
37 7 8 1
38 12 15 1
39 31 32 1
40 30 38 1
41 38 39 1
42 38 40 2
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