ATOM 43
1 C1y C 27.9948 -21.1639
2 C1y C 28.4040 -19.9119
3 C1y C 26.6823 -21.1639
4 O2a O 29.6742 -22.2657
5 O2a O 29.9392 -18.5514
6 O2x O 27.3326 -19.1474
7 C1y C 26.2852 -19.9119
8 C1b C 25.3762 -21.8924
9 C1y C 28.5906 -24.3424
10 C1y C 29.9090 -16.9259
11 C1a C 25.0390 -19.5025
12 O1a O 24.2503 -21.2241
13 C1y C 28.5906 -25.6667
14 O2x O 27.4408 -23.6864
15 C1y C 28.7772 -16.2578
16 C1y C 31.0588 -16.2578
17 C1y C 27.4408 -26.3350
18 C1y C 26.3091 -24.3424
19 C1y C 28.7772 -14.9335
20 N1b N 26.9473 -17.0764
21 C1y C 31.0588 -14.9335
22 O1a O 32.1905 -16.9080
23 C1y C 26.3091 -25.6667
24 O1a O 27.4408 -27.6473
25 C1b C 25.1775 -23.6864
26 C1y C 29.9090 -14.2772
27 O1a O 27.8609 -14.2008
28 C2c C 25.8155 -16.4203
29 O2b O 32.1905 -14.2713
30 O1a O 25.1713 -26.3170
31 O1a O 24.0396 -24.3424
32 N1b N 29.9030 -12.9649
33 N1a N 24.6778 -17.0704
34 N2a N 25.8215 -15.1081
35 C2c C 28.7713 -12.3148
36 N2a N 28.7652 -11.0085
37 N1a N 27.6395 -12.9709
38 N1b N 29.7977 -26.3613
39 C1a C 31.0070 -25.6606
40 P1b P 33.5905 -14.2713
41 O1c O 34.9905 -14.2713
42 O1c O 33.5905 -15.6713
43 O1c O 33.5905 -12.8713
BOND 45
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 2 5 1 #Up
5 2 6 1
6 3 7 1
7 3 8 1 #Up
8 9 4 1 #Up
9 10 5 1 #Down
10 7 11 1 #Down
11 8 12 1
12 9 13 1
13 9 14 1
14 10 15 1
15 10 16 1
16 13 17 1
17 14 18 1
18 15 19 1
19 15 20 1 #Up
20 16 21 1
21 16 22 1 #Up
22 17 23 1
23 17 24 1 #Down
24 18 25 1 #Down
25 19 26 1
26 19 27 1 #Down
27 20 28 1
28 21 29 1 #Down
29 23 30 1 #Up
30 25 31 1
31 26 32 1 #Up
32 28 33 1
33 28 34 2
34 32 35 1
35 35 36 2
36 35 37 1
37 6 7 1
38 18 23 1
39 21 26 1
40 13 38 1 #Up
41 38 39 1
42 29 40 1
43 40 41 1
44 40 42 1
45 40 43 2
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