ATOM 47
1 N4y N 38.2389 -18.1595
2 C8y C 36.9856 -17.7679
3 C1y C 37.9023 -20.3609
4 C8x C 38.9989 -17.0863
5 C8y C 36.9779 -16.4518
6 N5x N 35.8340 -18.4415
7 O2x O 36.8132 -19.5774
8 C1y C 37.5027 -21.5986
9 N5x N 38.2233 -16.0443
10 C8y C 35.8184 -15.7860
11 C8x C 34.6748 -17.7913
12 C1y C 35.7557 -20.3373
13 C1y C 36.1709 -21.5986
14 O1a O 38.2860 -22.6638
15 N5x N 34.6669 -16.4595
16 N1a N 35.8184 -14.4776
17 C1b C 34.5024 -19.9533
18 O1a O 35.4110 -22.6638
19 O2b O 33.4449 -19.9065
20 P1b P 32.0271 -19.8986
21 O2c O 30.2487 -19.9065
22 O1c O 32.0271 -21.4418
23 O1c O 32.0271 -18.4337
24 P1b P 28.6037 -19.8986
25 O2b O 27.1857 -19.9065
26 O1c O 28.6037 -21.3634
27 O1c O 28.6037 -18.4258
28 C1b C 25.8069 -19.8909
29 C1y C 24.5770 -20.3216
30 O2x O 23.4804 -19.5930
31 C1y C 24.2323 -21.6690
32 C1y C 22.4229 -20.4234
33 C1y C 22.8693 -21.7003
34 O1a O 25.0157 -22.6404
35 N1b N 21.1302 -19.6714
36 O1a O 22.1250 -22.7345
37 C2c C 19.8846 -18.9272
38 N1b N 18.6156 -19.6323
39 N2a N 19.9082 -17.4700
40 C1b C 17.3622 -18.8958
41 C1b C 16.0932 -19.6010
42 C1b C 14.8476 -18.8567
43 C1c C 13.5630 -19.5617
44 C6a C 12.3801 -18.7861
45 N1a N 13.6177 -21.0188
46 O6a O 11.1108 -19.4990
47 O6a O 12.4030 -17.3292
BOND 50
1 1 2 1
2 3 1 1 #Up
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 1
12 8 13 1
13 8 14 1 #Down
14 10 15 2
15 10 16 1
16 12 17 1 #Up
17 13 18 1 #Down
18 17 19 1
19 19 20 1
20 20 21 1
21 20 22 1
22 20 23 2
23 21 24 1
24 24 25 1
25 24 26 1
26 24 27 2
27 25 28 1
28 29 28 1 #Down
29 29 30 1
30 29 31 1
31 30 32 1
32 31 33 1
33 31 34 1 #Up
34 32 35 1 #Up
35 33 36 1 #Up
36 35 37 1
37 37 38 1
38 37 39 2
39 38 40 1
40 40 41 1
41 41 42 1
42 42 43 1
43 43 44 1
44 43 45 1 #Down
45 44 46 1
46 44 47 2
47 5 9 1
48 11 15 1
49 12 13 1
50 32 33 1
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