ATOM 25
1 C1x C 27.2800 -17.0422
2 C1y C 27.2566 -19.7724
3 C1x C 26.0161 -17.7044
4 C1y C 26.0745 -19.0725
5 C1x C 27.2566 -21.1400
6 C1z C 24.8937 -19.7607
7 C2x C 26.0628 -21.8212
8 C2y C 24.8877 -21.1285
9 C1x C 23.7125 -19.0666
10 C1a C 24.8820 -18.3927
11 C1x C 23.7125 -21.8153
12 C1x C 22.5245 -19.7607
13 C1y C 22.5245 -21.1285
14 O1a O 21.3305 -21.8153
15 C1a C 28.3799 -16.3627
16 C1z C 28.3863 -17.7247
17 C1y C 28.4448 -19.1017
18 C1x C 30.8274 -19.1217
19 C1x C 30.7691 -17.7447
20 C1y C 29.6500 -17.0496
21 C1c C 29.6614 -15.6874
22 N1c N 30.8493 -15.0127
23 C1a C 28.4921 -14.9928
24 C1a C 32.0256 -15.7001
25 C1a C 30.8608 -13.6504
BOND 28
1 11 13 1
2 13 14 1 #Up
3 3 4 1
4 7 8 2
5 12 13 1
6 16 15 1 #Up
7 16 1 1
8 17 2 1
9 1 3 1
10 2 4 1
11 2 5 1
12 4 6 1
13 16 17 1
14 18 19 1
15 19 20 1
16 20 16 1
17 17 18 1
18 5 7 1
19 20 21 1
20 6 8 1
21 21 22 1 #Down
22 6 9 1
23 21 23 1
24 6 10 1 #Up
25 22 24 1
26 8 11 1
27 22 25 1
28 9 12 1
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