ATOM 41
1 C5a C 30.6485 -14.0297
2 C8y C 31.8552 -14.7343
3 O5a O 30.6485 -12.6329
4 C8x C 31.8610 -16.1368
5 C8x C 33.0633 -14.0354
6 C8y C 33.0691 -16.8347
7 C8x C 34.2758 -14.7285
8 C8y C 34.2817 -16.1311
9 C1b C 33.0691 -18.2302
10 O1a O 35.4885 -16.8159
11 C2b C 34.2817 -18.9351
12 C2c C 34.2817 -20.3317
13 C1a C 35.4885 -21.0294
14 C1a C 33.0691 -21.0294
15 N1b N 29.4208 -14.7393
16 C8y C 25.4137 -12.7544
17 C8y C 25.4137 -14.1333
18 C8y C 24.2234 -12.0775
19 O7x O 26.6100 -12.0601
20 C8y C 26.6160 -14.8298
21 C8x C 24.2234 -14.8356
22 C8y C 23.0390 -12.7544
23 C1a C 24.2176 -10.7159
24 C8y C 27.8119 -12.7428
25 C8y C 27.8236 -14.1391
26 O1a O 26.6160 -16.1971
27 C8x C 23.0390 -14.1333
28 O2a O 21.8672 -12.0834
29 O6a O 28.9977 -12.0659
30 C1y C 20.6816 -12.7601
31 C1y C 20.6816 -14.1391
32 O2x O 19.4783 -12.0834
33 C1y C 19.4783 -14.8415
34 O1a O 21.7534 -15.1195
35 C1z C 18.3069 -12.7601
36 C1y C 18.3069 -14.1391
37 O1a O 19.4783 -16.2088
38 C1a C 17.4937 -11.3390
39 C1a C 16.8915 -13.0373
40 O2a O 17.1220 -14.8241
41 C1a C 15.7314 -14.8298
BOND 44
1 11 12 2
2 12 13 1
3 12 14 1
4 7 8 2
5 1 15 1
6 1 2 1
7 1 3 2
8 2 4 1
9 2 5 2
10 4 6 2
11 5 7 1
12 6 8 1
13 6 9 1
14 8 10 1
15 9 11 1
16 16 17 2
17 16 18 1
18 16 19 1
19 17 20 1
20 17 21 1
21 18 22 2
22 18 23 1
23 19 24 1
24 20 25 2
25 20 26 1
26 21 27 2
27 22 28 1
28 24 29 2
29 25 15 1
30 30 28 1 #Up
31 30 31 1
32 30 32 1
33 31 33 1
34 31 34 1 #Down
35 32 35 1
36 33 36 1
37 33 37 1 #Down
38 35 38 1
39 35 39 1
40 36 40 1 #Up
41 40 41 1
42 22 27 1
43 24 25 1
44 35 36 1
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