ATOM 22
1 N1y N 23.5845 -17.6505
2 C1y C 23.5961 -16.2610
3 C5x C 22.1948 -17.6621
4 C2y C 24.7933 -18.3634
5 C1z C 22.1948 -16.2610
6 S2x S 24.8109 -15.5726
7 O5x O 21.2019 -18.6552
8 C2y C 26.0078 -17.6679
9 C6a C 24.7875 -19.7649
10 N1b N 21.1961 -15.2621
11 C1x C 26.0138 -16.2726
12 O6a O 23.5670 -20.4590
13 O6a O 25.9962 -20.4650
14 C5a C 19.8413 -15.2808
15 R R 18.8553 -14.2878
16 O5a O 19.4796 -16.6354
17 R R 22.8116 -14.8520
18 C1b C 27.2202 -18.3788
19 O7a O 28.4395 -17.6797
20 C7a C 29.6463 -18.3813
21 N1a N 30.8571 -17.6870
22 O6a O 29.7120 -19.7771
BOND 23
1 2 6 1
2 3 7 2
3 4 8 2
4 4 9 1
5 5 10 1
6 6 11 1
7 9 12 1
8 9 13 2
9 10 14 1
10 14 15 1
11 14 16 2
12 3 5 1
13 8 11 1
14 5 17 1 #Down
15 1 2 1
16 8 18 1
17 1 3 1
18 18 19 1
19 19 20 1
20 1 4 1
21 20 21 1
22 2 5 1
23 20 22 2
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