ATOM 31
1 C1x C 26.0638 -17.0591
2 C1y C 26.0404 -19.8160
3 C1x C 24.8563 -17.7280
4 C1y C 24.8446 -19.1095
5 C1x C 26.0404 -21.1974
6 C1z C 23.6573 -19.8043
7 C1x C 24.8329 -21.8781
8 C1y C 23.6513 -21.1859
9 C1x C 22.4626 -19.1036
10 C1a C 23.6456 -18.4231
11 C1x C 22.4626 -21.8722
12 C1x C 21.2611 -19.8043
13 C1y C 21.2611 -21.1859
14 N1a N 20.0605 -21.8722
15 C1a C 27.2399 -16.3727
16 C1z C 27.2465 -17.7481
17 C1y C 27.2349 -19.1387
18 C1x C 29.7148 -19.0888
19 C1y C 29.6564 -17.7683
20 C1y C 28.4608 -17.0664
21 O1a O 30.9209 -17.5069
22 C1c C 28.4794 -15.6837
23 C1y C 29.6773 -15.0155
24 C1a C 27.2931 -14.9833
25 N1x N 30.8506 -15.7162
26 C1x C 32.0553 -15.0480
27 C1y C 32.0740 -13.6722
28 C1x C 30.8876 -12.9649
29 C1y C 29.6898 -13.6402
30 C1a C 33.2718 -12.9969
31 O1a O 28.5091 -12.9353
BOND 35
1 16 15 1 #Up
2 16 1 1
3 17 2 1
4 1 3 1
5 2 4 1
6 2 5 1
7 16 17 1
8 18 19 1
9 19 20 1
10 20 16 1
11 17 18 1
12 4 6 1
13 19 21 1 #Down
14 5 7 1
15 6 8 1
16 20 22 1
17 6 9 1
18 22 23 1
19 6 10 1 #Up
20 22 24 1 #Down
21 8 11 1
22 9 12 1
23 11 13 1
24 13 14 1 #Up
25 3 4 1
26 23 25 1
27 25 26 1
28 26 27 1
29 27 28 1
30 28 29 1
31 29 23 1
32 7 8 1
33 27 30 1 #Up
34 12 13 1
35 29 31 1 #Up
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