ATOM 28
1 C1z C 26.6817 -15.9600
2 C1y C 25.4507 -15.2366
3 C1y C 27.9243 -15.2542
4 C1y C 26.6700 -17.3835
5 C1x C 26.9385 -15.0033
6 C1z C 24.2083 -15.9426
7 C1z C 25.4624 -13.8074
8 C1y C 27.9359 -13.8249
9 C1y C 29.1609 -15.9774
10 C1x C 25.4391 -18.0952
11 O7x O 27.9068 -18.1069
12 O2x O 26.6525 -13.9882
13 C1y C 24.1966 -17.3775
14 C1y C 22.9715 -15.2309
15 C1a C 24.1907 -14.6475
16 C1y C 26.6993 -13.1015
17 O1a O 24.2200 -12.8740
18 C1a C 29.1785 -13.1191
19 C7x C 29.2194 -17.4068
20 O1a O 30.4095 -15.2716
21 C2y C 22.9715 -18.0893
22 C5x C 21.7289 -15.9426
23 O1a O 22.9715 -13.7958
24 O1a O 26.7109 -11.6665
25 O6a O 30.3861 -18.1302
26 C2x C 21.7289 -17.3775
27 C1a C 22.9774 -19.5244
28 O5x O 20.4865 -15.2309
BOND 32
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 4 11 1
11 5 12 1
12 6 13 1
13 6 14 1
14 6 15 1 #Up
15 7 16 1
16 7 17 1
17 8 18 1 #Down
18 9 19 1
19 9 20 1 #Up
20 13 21 1
21 14 22 1
22 14 23 1 #Up
23 16 24 1 #Down
24 19 25 2
25 21 26 2
26 21 27 1
27 22 28 2
28 7 12 1 #Up
29 8 16 1
30 10 13 1
31 11 19 1
32 22 26 1
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