ATOM 47
1 C1z C 28.4122 -17.5590
2 C1y C 29.6017 -18.1363
3 C1y C 27.3216 -18.1304
4 O2x O 29.4666 -16.8567
5 C1y C 28.3946 -16.2469
6 C1y C 30.6864 -17.3956
7 C1y C 29.8875 -19.4192
8 C1z C 26.9253 -19.3842
9 C2x C 26.2488 -17.3666
10 C1z C 30.5930 -12.8411
11 C1y C 29.4269 -15.5004
12 C1a C 27.1525 -15.6638
13 C1z C 30.6690 -16.0895
14 O2x O 31.9785 -17.7844
15 C1z C 29.0537 -20.4279
16 O2x O 30.2777 -20.4274
17 C1y C 27.7415 -20.4163
18 C5x C 25.6131 -19.4016
19 O1a O 26.7080 -20.5493
20 C2y C 25.1992 -18.1538
21 O2x O 30.5990 -14.9175
22 C8y C 30.5814 -12.1592
23 O7a O 29.3393 -14.2059
24 C2c C 32.1094 -15.3606
25 C1b C 29.3860 -21.6876
26 O1a O 27.7299 -21.7226
27 O5x O 24.8610 -20.4746
28 C1a C 23.9454 -17.7631
29 C8x C 31.7185 -11.4944
30 C8x C 29.4502 -11.5119
31 C7a C 28.2022 -13.5412
32 C1a C 32.0977 -14.0368
33 C2a C 33.2348 -16.0137
34 O1a O 30.6864 -21.6876
35 C8x C 31.7127 -10.1823
36 C8x C 29.4443 -10.1940
37 C2b C 27.0710 -14.2002
38 O6a O 28.2022 -12.2292
39 C8x C 30.5697 -9.5352
40 C2b C 25.9339 -13.5412
41 C2b C 24.8084 -14.2002
42 C2b C 23.6713 -13.5412
43 C2b C 22.5459 -14.2002
44 C2b C 21.4029 -13.5412
45 C1b C 20.2774 -14.2002
46 C1b C 19.1463 -13.5412
47 C1a C 18.0149 -14.2002
BOND 53
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 1 5 1
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 5 11 1
11 5 12 1 #Down
12 6 13 1
13 6 14 1 #Down
14 7 15 1
15 7 16 1
16 8 17 1
17 8 18 1
18 8 19 1 #Up
19 9 20 2
20 10 21 1
21 10 22 1
22 11 23 1 #Up
23 13 24 1 #Up
24 15 25 1 #Up
25 17 26 1 #Up
26 18 27 2
27 20 28 1
28 22 29 1
29 22 30 2
30 23 31 1
31 24 32 1
32 24 33 2
33 25 34 1
34 29 35 2
35 30 36 1
36 31 37 1
37 31 38 2
38 35 39 1
39 37 40 2
40 40 41 1
41 41 42 2
42 42 43 1
43 43 44 2
44 44 45 1
45 45 46 1
46 46 47 1
47 10 14 1
48 11 13 1
49 13 21 1 #Down
50 15 16 1
51 15 17 1
52 18 20 1
53 36 39 2
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