ATOM 44
1 C1y C 24.3960 -23.6934
2 C1y C 24.7937 -22.4414
3 C1z C 23.0855 -23.6934
4 O2a O 26.0587 -24.7887
5 O2a O 26.3194 -21.0917
6 O2x O 23.7375 -21.6851
7 C1y C 22.6878 -22.4414
8 C4a C 21.7880 -24.4172
9 O1a O 23.0855 -24.9387
10 C1y C 24.9828 -26.8556
11 C1y C 26.2935 -19.4748
12 C1a C 21.4489 -22.0371
13 O4a O 20.6665 -23.7520
14 C1y C 24.9828 -28.1728
15 O2x O 23.8418 -26.2037
16 C1y C 25.1654 -18.8032
17 C1y C 27.4345 -18.8032
18 C1y C 23.8418 -28.8378
19 N1b N 26.5346 -29.4181
20 C1y C 22.7137 -26.8556
21 C1y C 25.1654 -17.4926
22 N1b N 23.3462 -19.6248
23 C1y C 27.4345 -17.4926
24 O1a O 28.5690 -19.4552
25 C1y C 22.7137 -28.1728
26 O2b O 23.8354 -30.1353
27 C1a C 26.5346 -30.7221
28 C1b C 21.5858 -26.2037
29 C1y C 26.2935 -16.8407
30 O1a O 24.1809 -16.5472
31 C2c C 22.2248 -18.9662
32 O1a O 28.5626 -16.8340
33 O1a O 21.5858 -28.8182
34 P1b P 23.8354 -31.4329
35 O1a O 20.4577 -26.8556
36 N1b N 26.2935 -15.5365
37 N1a N 21.0902 -19.6182
38 N2a N 22.2314 -17.6687
39 O1c O 22.5313 -31.4329
40 O1c O 25.1393 -31.4262
41 O1c O 23.8354 -32.7370
42 C2c C 25.1590 -14.8910
43 N1a N 25.1590 -13.5870
44 N2a N 24.0373 -15.5430
BOND 46
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 3 9 1
9 10 4 1 #Up
10 11 5 1 #Down
11 7 12 1 #Down
12 8 13 2
13 10 14 1
14 10 15 1
15 11 16 1
16 11 17 1
17 14 18 1
18 14 19 1 #Up
19 15 20 1
20 16 21 1
21 16 22 1 #Up
22 17 23 1
23 17 24 1 #Up
24 18 25 1
25 18 26 1 #Down
26 19 27 1
27 20 28 1 #Down
28 21 29 1
29 21 30 1 #Down
30 22 31 1
31 23 32 1 #Down
32 25 33 1 #Up
33 26 34 1
34 28 35 1
35 29 36 1 #Up
36 31 37 1
37 31 38 2
38 34 39 1
39 34 40 1
40 34 41 2
41 36 42 1
42 42 43 1
43 42 44 2
44 6 7 1
45 20 25 1
46 23 29 1
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