ATOM 28
1 C1y C 28.3739 -18.6207
2 C1y C 29.7364 -18.3063
3 C8y C 27.2676 -17.7531
4 O2x O 27.9663 -19.9542
5 C8y C 30.6913 -19.3311
6 N1y N 30.3420 -17.0370
7 C8y C 27.2676 -16.3616
8 C8x C 26.0682 -18.4578
9 C1y C 28.9212 -20.9847
10 C8y C 30.2837 -20.6646
11 C8x C 32.0538 -19.0226
12 C1x C 29.7305 -15.7794
13 C1a C 31.7394 -17.0370
14 C8x C 26.0682 -15.6570
15 C1x C 28.3623 -15.4766
16 C8y C 24.8512 -17.7591
17 O2a O 28.5428 -22.3239
18 C8y C 31.2212 -21.6894
19 C8x C 33.0030 -20.0415
20 C8y C 24.8512 -16.3557
21 O2x O 23.5120 -18.1900
22 C1a C 27.1860 -22.6849
23 C8y C 32.5837 -21.3750
24 O2x O 31.0930 -23.0868
25 O2x O 23.5178 -15.9133
26 C1x C 22.6911 -17.0487
27 O2x O 33.3057 -22.5803
28 C1x C 32.3799 -23.6341
BOND 33
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 2
10 5 11 1
11 6 12 1
12 6 13 1
13 7 14 1
14 7 15 1
15 8 16 2
16 9 17 1 #Up
17 10 18 1
18 11 19 2
19 14 20 2
20 16 21 1
21 17 22 1
22 18 23 2
23 18 24 1
24 20 25 1
25 21 26 1
26 23 27 1
27 24 28 1
28 9 10 1
29 12 15 1
30 16 20 1
31 19 23 1
32 25 26 1
33 27 28 1
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