ATOM 37
1 C1y C 22.2065 -20.0779
2 C1x C 22.1718 -21.4540
3 O2x O 20.9227 -19.4085
4 C1y C 20.9929 -22.1739
5 C1y C 19.8191 -20.1311
6 C1y C 19.7817 -21.5123
7 O2a O 21.0282 -23.5500
8 C1a C 18.5403 -19.4773
9 O1a O 18.6053 -22.2399
10 C1a C 19.8440 -24.2802
11 C1z C 30.5020 -16.6531
12 C1z C 29.3140 -17.3343
13 O2x O 30.4904 -18.0274
14 C1z C 30.5194 -15.2846
15 C1x C 32.8836 -16.6822
16 C1y C 28.1320 -16.6415
17 C1x C 29.3140 -18.7145
18 C1y C 31.7191 -14.6092
19 C1x C 29.3373 -14.5859
20 C1a C 30.5078 -13.9046
21 C1x C 32.8952 -15.3138
22 C1z C 26.9266 -17.3227
23 C1x C 28.1379 -15.2613
24 C1x C 28.1146 -19.3957
25 C2y C 31.7364 -13.2292
26 C1y C 26.9209 -18.7028
27 C1x C 25.7388 -16.6356
28 C1a C 26.9149 -15.9427
29 C2x C 33.1107 -13.2292
30 C1x C 31.3055 -11.9248
31 C1x C 25.7388 -19.3900
32 C1x C 24.5451 -17.3227
33 C7x C 33.5300 -11.9248
34 O7x O 32.4236 -11.1155
35 C1y C 24.5451 -18.7028
36 O6a O 34.8401 -11.4939
37 O2a O 23.3513 -19.3900
BOND 43
1 6 9 1 #Up
2 7 10 1
3 5 6 1
4 1 2 1
5 1 3 1
6 2 4 1
7 3 5 1
8 4 6 1
9 4 7 1 #Up
10 11 12 1
11 11 13 1 #Up
12 11 14 1
13 11 15 1
14 12 16 1
15 12 17 1
16 14 18 1
17 14 19 1
18 14 20 1 #Up
19 15 21 1
20 16 22 1
21 16 23 1
22 17 24 1
23 18 25 1
24 22 26 1
25 22 27 1
26 22 28 1 #Up
27 25 29 2
28 25 30 1
29 26 31 1
30 27 32 1
31 29 33 1
32 30 34 1
33 31 35 1
34 33 36 2
35 35 37 1 #Up
36 12 13 1 #Up
37 18 21 1
38 19 23 1
39 24 26 1
40 32 35 1
41 33 34 1
42 1 37 1 #Up
43 5 8 1 #Up
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