ATOM 31
1 C1x C 20.3114 -26.8925
2 C1y C 20.3114 -28.2698
3 C1x C 21.5041 -28.9584
4 C1y C 22.6969 -28.2698
5 C1z C 22.6969 -26.8925
6 C1x C 21.5041 -26.2039
7 C1y C 23.8897 -28.9584
8 C1x C 25.0825 -28.2698
9 C1y C 25.0825 -26.8925
10 C1y C 23.8897 -26.2039
11 C1x C 23.8897 -24.8265
12 C1y C 26.2607 -26.2122
13 C1y C 26.2607 -24.8348
14 C1x C 27.4534 -26.9009
15 C1x C 28.6461 -26.2122
16 C1y C 28.6461 -24.8348
17 C1y C 27.4534 -24.1462
18 C1z C 29.8390 -24.1462
19 C1y C 29.8390 -22.7689
20 N1y N 28.6461 -22.0803
21 C1x C 27.4534 -22.7689
22 C1x C 31.0317 -22.0803
23 C1x C 31.0317 -20.7030
24 C1y C 29.8390 -20.0143
25 C1x C 28.6461 -20.7030
26 C1a C 29.8390 -18.6371
27 C1a C 31.2162 -24.1462
28 O1a O 30.5276 -25.3390
29 C1a C 22.6969 -25.5152
30 O1a O 19.1186 -28.9584
31 O1a O 23.8897 -30.3357
BOND 36
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 10 11 1
13 9 12 1
14 12 13 1
15 11 13 1
16 12 14 1
17 14 15 1
18 15 16 1
19 16 17 1
20 13 17 1
21 16 18 1
22 18 19 1
23 19 20 1
24 20 21 1
25 17 21 1
26 19 22 1
27 22 23 1
28 23 24 1
29 24 25 1
30 20 25 1
31 24 26 1 #Down
32 18 27 1 #Down
33 18 28 1 #Up
34 5 29 1 #Up
35 2 30 1 #Up
36 7 31 1 #Down
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