ATOM 31
1 C1x C 18.0327 -9.4796
2 C1y C 18.0327 -10.8639
3 C1z C 19.2315 -11.5560
4 C1y C 20.4304 -10.8639
5 C1z C 20.4304 -9.4796
6 C1x C 19.2315 -8.7875
7 C1x C 21.6291 -11.5560
8 C1x C 22.8279 -10.8639
9 C1y C 22.8279 -9.4796
10 C2y C 21.6291 -8.7875
11 C1z C 24.0267 -8.7875
12 C1z C 24.0267 -7.4032
13 C1x C 22.8279 -6.7111
14 C2x C 21.6291 -7.4032
15 C1x C 25.2255 -9.4796
16 C1x C 26.4243 -8.7875
17 C1z C 26.4243 -7.4032
18 C1y C 25.2255 -6.7111
19 C1x C 25.2255 -5.3269
20 C1y C 27.6230 -6.7111
21 C1x C 27.6230 -5.3269
22 C1c C 28.8444 -7.4165
23 C1a C 30.0380 -6.7274
24 C1a C 28.8440 -8.7874
25 C1a C 24.0267 -6.0190
26 C1a C 20.4304 -8.0953
27 O1a O 16.8340 -11.5560
28 C1a C 18.5394 -12.7547
29 C1a C 19.8642 -12.6731
30 C1a C 24.0267 -10.1718
31 C1a C 27.6177 -8.0928
BOND 35
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 1
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 2
17 11 15 1
18 15 16 1
19 16 17 1
20 17 18 1
21 12 18 1
22 18 19 1
23 17 20 1
24 20 21 1
25 20 22 1 #Up
26 22 23 1
27 22 24 1
28 12 25 1 #Up
29 5 26 1 #Up
30 2 27 1 #Up
31 3 28 1
32 3 29 1
33 11 30 1 #Down
34 19 21 1
35 17 31 1 #Up
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