ATOM 25
1 C1y C 28.3762 -18.8054
2 N1y N 28.3762 -20.1969
3 C2y C 29.5815 -20.8926
4 C2x C 30.7865 -20.1969
5 C1x C 30.7865 -18.8054
6 S2x S 29.5815 -18.1097
7 C1y C 26.9846 -18.8054
8 C5x C 26.9846 -20.1969
9 N1b N 25.7798 -18.1097
10 C5a C 24.5746 -18.8054
11 O5a O 24.5746 -20.1969
12 O5x O 25.7798 -20.8926
13 C2c C 23.3694 -18.1097
14 C8y C 22.1451 -18.8170
15 C8x C 21.0127 -17.9852
16 S2x S 19.8670 -18.8035
17 C8y C 20.2912 -20.2160
18 N5x N 21.6991 -20.1574
19 N2b N 23.3693 -16.6968
20 C6a C 29.5815 -22.3009
21 O6a O 30.7972 -23.0028
22 O6a O 28.3673 -23.0020
23 N1a N 19.4862 -21.3463
24 O2a O 24.5751 -16.0008
25 C1a C 24.5751 -14.6008
BOND 27
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 1
8 7 8 1
9 2 8 1
10 7 9 1 #Up
11 9 10 1
12 10 11 2
13 8 12 2
14 10 13 1
15 13 14 1
16 14 15 2
17 15 16 1
18 16 17 1
19 17 18 2
20 14 18 1
21 13 19 2
22 3 20 1
23 20 21 1
24 20 22 2
25 17 23 1
26 19 24 1
27 24 25 1
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