ATOM 27
1 C1y C 26.4210 -20.0488
2 C1y C 25.2503 -20.7244
3 C1z C 26.4210 -18.6975
4 C1x C 28.7623 -20.0488
5 C1y C 24.0854 -20.0488
6 C1x C 25.2444 -22.0757
7 C1y C 27.6034 -18.0220
8 C1x C 25.2503 -18.0220
9 C1a C 26.4151 -17.3463
10 C1x C 28.7623 -18.6975
11 C1z C 22.9031 -20.7244
12 C1x C 24.0854 -18.6975
13 C1c C 27.6034 -16.6707
14 C2y C 22.9031 -22.0757
15 C1x C 21.7383 -20.0488
16 C1a C 22.8914 -19.3732
17 C1b C 28.7973 -15.9834
18 C1a C 26.4034 -15.9777
19 C2x C 21.7383 -22.7513
20 C1x C 20.5676 -20.7244
21 C1b C 29.9913 -16.6764
22 C5x C 20.5676 -22.0757
23 C1b C 31.1853 -15.9834
24 O5x O 19.3853 -22.7513
25 C1c C 32.3851 -16.6764
26 C1a C 33.5791 -15.9892
27 C1a C 32.3793 -18.2663
BOND 30
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 3 9 1 #Up
9 4 10 1
10 5 11 1
11 5 12 1
12 7 13 1
13 11 14 1
14 11 15 1
15 11 16 1 #Up
16 13 17 1
17 13 18 1 #Down
18 14 19 2
19 15 20 1
20 17 21 1
21 19 22 1
22 21 23 1
23 22 24 2
24 23 25 1
25 25 26 1
26 25 27 1
27 7 10 1
28 8 12 1
29 20 22 1
30 14 6 1
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