ATOM 37
1 C1x C 12.6887 -17.7885
2 C1y C 12.6887 -19.1461
3 C1z C 13.8645 -19.8250
4 C2y C 15.0401 -19.1461
5 C1y C 15.0401 -17.7885
6 C1x C 13.8645 -17.1097
7 C2x C 16.2160 -19.8250
8 C1x C 17.3916 -19.1461
9 C1y C 17.3916 -17.7885
10 C1z C 16.2160 -17.1097
11 C1z C 18.5675 -17.1097
12 C1z C 18.5675 -15.7521
13 C1x C 17.3916 -15.0733
14 C5x C 16.2160 -15.7521
15 C1y C 19.7632 -15.0615
16 C1y C 20.9328 -15.7366
17 C1d C 19.7630 -13.7158
18 C5a C 20.9274 -13.0429
19 C2b C 22.0818 -13.7091
20 C2b C 23.2353 -13.0427
21 C1d C 24.3898 -13.7090
22 C1a C 25.5432 -13.0426
23 C1a C 24.3902 -15.0730
24 C1x C 20.9328 -17.0941
25 C1a C 12.9045 -20.7850
26 C1a C 14.8243 -20.7850
27 C1a C 18.5760 -13.0310
28 C1a C 18.5675 -18.4673
29 O1a O 11.5129 -19.8250
30 C1b C 14.8289 -16.1773
31 C1a C 18.5675 -14.3946
32 O1a O 13.2189 -16.1894
33 O1a O 25.7356 -14.2088
34 O1a O 19.7630 -11.9729
35 O5a O 20.9271 -11.6456
36 O1a O 22.1172 -15.2620
37 O5x O 15.0208 -15.0619
BOND 40
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 2
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 12 15 1
18 15 16 1
19 15 17 1
20 17 18 1
21 18 19 1
22 19 20 2
23 20 21 1
24 21 22 1
25 21 23 1
26 16 24 1
27 24 11 1
28 3 25 1
29 3 26 1
30 17 27 1 #Down
31 11 28 1 #Down
32 2 29 1 #Up
33 10 30 1 #Up
34 12 31 1 #Up
35 30 32 1
36 21 33 1
37 17 34 1 #Up
38 18 35 2
39 16 36 1 #Down
40 14 37 2
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