ATOM 56
1 C1y C 19.7251 -21.4618
2 C1b C 20.9321 -22.1539
3 C1c C 22.3493 -21.4618
4 O1a O 22.3493 -20.0633
5 C1x C 17.3113 -20.0633
6 C1x C 17.3113 -21.4618
7 C1y C 18.5182 -22.1539
8 O2x O 19.7251 -20.0633
9 C1z C 18.5182 -19.3570
10 C1b C 13.7930 -10.9943
11 C1c C 15.0000 -10.2879
12 C2b C 13.7930 -12.3927
13 C2b C 12.5968 -13.0880
14 C2b C 12.5969 -14.4783
15 C2b C 13.7971 -15.1698
16 C1c C 13.7940 -16.5616
17 C1b C 15.0020 -17.2669
18 C1c C 16.2069 -10.9943
19 C1d C 17.4143 -10.2962
20 C5a C 18.6235 -11.0044
21 C1c C 19.8348 -10.3048
22 C1c C 21.0474 -11.0156
23 C5a C 23.4762 -11.0292
24 C1c C 22.2620 -10.3157
25 C1c C 23.4684 -12.4348
26 C1c C 24.6552 -14.5527
27 C1c C 24.6762 -13.1451
28 C2b C 23.4296 -15.2396
29 C7a C 22.1751 -17.3160
30 C2b C 23.4784 -16.6394
31 O7a O 20.9734 -16.5899
32 C1y C 19.7468 -17.2684
33 C1y C 18.5453 -16.5337
34 C1b C 16.1088 -16.4713
35 C1y C 17.3128 -17.2116
36 C1a C 14.9867 -8.8894
37 O1a O 16.1945 -12.3927
38 C1a C 18.3982 -9.2991
39 O1a O 16.4133 -9.2991
40 O5a O 18.6101 -12.3997
41 C1a C 19.8248 -8.9035
42 O1a O 21.0398 -12.4139
43 C1a C 22.2547 -8.9106
44 O5a O 24.6772 -10.3162
45 C1a C 22.2476 -13.1202
46 O1a O 25.8781 -12.4351
47 C1a C 25.8569 -15.2462
48 O6a O 22.1628 -18.7141
49 C1a C 18.5323 -15.1332
50 C1b C 12.5781 -17.2521
51 C1a C 11.3634 -16.5528
52 C1y C 19.7331 -18.6648
53 C1a C 20.9409 -19.3641
54 O2x O 17.3033 -18.6577
55 C1a C 18.5111 -23.5524
56 C1a C 23.5523 -22.1610
BOND 58
1 29 30 1
2 5 9 1
3 6 7 1
4 31 32 1
5 33 32 1
6 7 1 1
7 15 16 1
8 16 17 1
9 33 35 1
10 34 35 1
11 17 34 1
12 11 36 1 #Up
13 1 8 1
14 18 37 1 #Up
15 9 8 1 #Down
16 19 38 1 #Down
17 18 19 1
18 19 39 1 #Up
19 20 19 1
20 20 40 2
21 10 12 1
22 21 41 1 #Up
23 22 42 1 #Up
24 20 21 1
25 24 43 1 #Up
26 22 21 1
27 23 44 2
28 1 2 1
29 25 45 1 #Down
30 10 11 1
31 27 46 1 #Down
32 18 11 1
33 26 47 1 #Up
34 22 24 1
35 29 48 2
36 25 23 1
37 23 24 1
38 33 49 1 #Up
39 2 3 1
40 3 4 1 #Down
41 5 6 1
42 16 50 1
43 25 27 1
44 50 51 1
45 28 26 1
46 32 52 1
47 26 27 1
48 52 53 1 #Down
49 52 9 1
50 12 13 2
51 9 54 1
52 54 35 1
53 13 14 1
54 7 55 1 #Up
55 14 15 2
56 28 30 2
57 3 56 1
58 31 29 1
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