ATOM 40
1 O2x O 17.2001 -17.9673
2 C1y C 17.2001 -19.3706
3 C1y C 18.3928 -20.0722
4 C1y C 19.6558 -19.3706
5 C1y C 19.6558 -17.9673
6 C1y C 18.3928 -17.2657
7 O2x O 20.9889 -19.7915
8 C1z C 21.8308 -18.6689
9 O2x O 20.9889 -17.5463
10 O2x O 23.0236 -19.3706
11 C1y C 24.2163 -18.6689
12 C1y C 24.2163 -17.2657
13 C1y C 23.0236 -16.5641
14 C1y C 21.8308 -17.2657
15 O2a O 18.3928 -15.8624
16 C1b C 16.0073 -20.0722
17 O1a O 18.3928 -21.4754
18 O1a O 25.4091 -16.5641
19 C1y C 17.2001 -15.1608
20 C1y C 17.2001 -13.7576
21 C1y C 16.0073 -13.0559
22 C1x C 14.7444 -13.7576
23 C1y C 14.7444 -15.1608
24 C1y C 16.0073 -15.8624
25 C1c C 25.4091 -19.3706
26 C1b C 26.6720 -18.6689
27 O2b O 27.8648 -19.3706
28 N1a N 25.4091 -20.7738
29 O1a O 23.0236 -15.1608
30 O1a O 21.1292 -16.0729
31 N1a N 13.5516 -15.8624
32 N1b N 16.0073 -11.6527
33 O1a O 18.3928 -13.0559
34 O1a O 16.0073 -17.2657
35 O1a O 14.8146 -19.3706
36 C1a C 17.2001 -10.9511
37 P1b P 29.2681 -19.3706
38 O1c O 30.6713 -19.3706
39 O1c O 29.2681 -20.7738
40 O1c O 29.2681 -17.9673
BOND 43
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 5 9 1
11 8 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 8 14 1
17 6 15 1 #Up
18 2 16 1 #Up
19 3 17 1 #Up
20 12 18 1 #Up
21 19 15 1 #Down
22 19 20 1
23 20 21 1
24 21 22 1
25 22 23 1
26 23 24 1
27 19 24 1
28 11 25 1
29 25 26 1
30 26 27 1
31 25 28 1 #Down
32 13 29 1 #Up
33 14 30 1 #Down
34 23 31 1 #Down
35 21 32 1 #Down
36 20 33 1 #Up
37 24 34 1 #Up
38 16 35 1
39 32 36 1
40 27 37 1
41 37 38 2
42 37 39 1
43 37 40 1
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