ATOM 44
1 C1z C 15.3234 -15.8704
2 O2x O 14.1812 -15.2090
3 C1x C 15.3234 -17.1846
4 O2b O 17.4194 -17.4455
5 C6a C 16.4522 -15.2090
6 C1y C 13.0409 -15.8704
7 C1y C 14.1812 -17.8631
8 P1b P 18.7407 -17.4455
9 O6a O 16.4232 -13.9006
10 O6a O 17.5815 -15.8704
11 C1y C 13.0409 -17.1846
12 O1a O 14.1871 -19.1659
13 O2b O 20.0436 -17.4455
14 O1c O 18.7407 -18.8938
15 O1c O 18.7407 -15.9224
16 C1b C 21.3591 -17.4455
17 C1y C 22.6044 -17.8343
18 O2x O 23.6646 -17.0627
19 C1y C 23.0218 -19.0796
20 C1y C 24.7419 -17.8515
21 C1y C 24.3545 -19.0796
22 O1a O 22.2686 -20.1456
23 N4y N 25.5768 -15.6552
24 O1a O 25.1248 -20.1341
25 C8y C 24.4291 -14.9895
26 C8x C 26.7233 -15.0125
27 N5x N 24.3890 -13.6741
28 O5x O 23.3000 -15.6378
29 C8x C 26.7233 -13.6798
30 C8y C 25.5826 -13.0139
31 N1a N 25.5826 -11.7041
32 C1c C 11.8424 -15.1577
33 C1c C 11.8473 -13.7812
34 C1b C 10.6576 -13.0889
35 N1b N 11.6317 -18.1448
36 O1a O 13.0321 -13.0971
37 O1a O 10.6405 -15.8385
38 C5a C 11.6314 -19.5223
39 O5a O 12.8243 -20.2105
40 C1a C 10.4394 -20.2105
41 O7a O 9.4291 -13.7927
42 C7a C 8.2336 -13.0969
43 C1a C 7.0417 -13.7797
44 O6a O 8.2383 -11.6902
BOND 46
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 1 5 1 #Down
5 2 6 1
6 3 7 1
7 4 8 1
8 5 9 1
9 5 10 2
10 6 11 1
11 7 12 1 #Down
12 8 13 1
13 8 14 1
14 8 15 2
15 13 16 1
16 17 16 1 #Up
17 17 18 1
18 17 19 1
19 18 20 1
20 19 21 1
21 19 22 1 #Down
22 20 23 1 #Up
23 21 24 1 #Down
24 23 25 1
25 23 26 1
26 25 27 1
27 25 28 2
28 26 29 2
29 27 30 2
30 30 31 1
31 7 11 1
32 20 21 1
33 29 30 1
34 6 32 1
35 32 33 1
36 33 34 1
37 11 35 1 #Up
38 33 36 1 #Up
39 32 37 1 #Down
40 35 38 1
41 38 39 2
42 38 40 1
43 34 41 1
44 41 42 1
45 42 43 1
46 42 44 2
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