ATOM 41
1 C1z C 23.1221 -30.1842
2 C1y C 24.3042 -30.8747
3 C1y C 21.9226 -30.8572
4 C5x C 23.1338 -28.8092
5 C1b C 21.9168 -29.4822
6 C1z C 25.4977 -30.1959
7 C1x C 24.3042 -32.2498
8 C2y C 21.9168 -32.2381
9 C1x C 20.7348 -30.1784
10 C1x C 24.3276 -28.1247
11 C1z C 25.5094 -28.8267
12 C1x C 27.8676 -30.1553
13 C1a C 25.4803 -31.5651
14 C2x C 23.1104 -32.9343
15 C1z C 20.7348 -32.9343
16 C1y C 19.5353 -30.8572
17 C1y C 26.6389 -28.1539
18 C1a C 25.5037 -27.4460
19 C1y C 27.8850 -28.8561
20 C5x C 19.5353 -32.2381
21 C1a C 20.0327 -34.1280
22 C1a C 21.4078 -34.1280
23 O1a O 18.3358 -30.1784
24 C1d C 26.6972 -26.7730
25 O1a O 29.0788 -28.1539
26 O5x O 18.3358 -32.9343
27 C5a C 27.8793 -26.0885
28 C1a C 25.5037 -26.0885
29 O1a O 26.6915 -24.9021
30 C2b C 29.0788 -26.7672
31 O5a O 27.8793 -24.7076
32 C2b C 30.2666 -26.0825
33 C1d C 31.4602 -26.7613
34 O7a O 31.4544 -28.1422
35 C1a C 32.6539 -26.0651
36 C1a C 32.6539 -27.4517
37 C7a C 31.4484 -29.5231
38 C1a C 32.6362 -30.2193
39 O6a O 30.2432 -30.2076
40 O1a O 20.5168 -29.4822
41 O5x O 21.9144 -28.0954
BOND 44
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 6 11 1
11 6 12 1
12 6 13 1 #Down
13 7 14 1
14 8 15 1
15 9 16 1
16 11 17 1
17 11 18 1 #Up
18 12 19 1
19 15 20 1
20 15 21 1
21 15 22 1
22 16 23 1 #Up
23 17 24 1
24 19 25 1 #Down
25 20 26 2
26 24 27 1
27 24 28 1 #Down
28 24 29 1 #Up
29 27 30 1
30 27 31 2
31 30 32 2
32 32 33 1
33 33 34 1
34 33 35 1
35 33 36 1
36 34 37 1
37 37 38 1
38 37 39 2
39 8 14 2
40 10 11 1
41 16 20 1
42 17 19 1
43 5 40 1
44 4 41 2
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