ATOM 22
1 C1y C 31.2811 -23.9460
2 C1y C 31.2811 -25.3672
3 C1y C 32.5118 -26.0777
4 C1y C 33.7425 -25.3672
5 C1y C 33.7425 -23.9460
6 C1y C 32.5118 -23.2356
7 O7a O 32.5118 -21.3947
8 N1b N 30.0504 -26.0777
9 O1a O 34.9921 -26.0889
10 O2b O 32.5118 -27.4986
11 O1a O 30.6178 -23.0936
12 C2c C 28.8425 -25.3672
13 N1a N 27.6117 -26.0777
14 N2a N 28.8482 -24.0883
15 C7a C 31.2583 -20.6839
16 N1a N 30.0275 -21.3945
17 O6a O 31.2527 -19.2631
18 O1a O 34.9808 -23.2313
19 P1b P 32.5118 -28.9169
20 O1c O 33.9301 -28.9169
21 O1c O 31.0935 -28.9169
22 O1c O 32.5118 -30.3352
BOND 22
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 6 7 1 #Up
8 2 8 1 #Up
9 4 9 1 #Up
10 3 10 1 #Down
11 1 11 1 #Down
12 8 12 1
13 12 13 1
14 12 14 2
15 7 15 1
16 15 16 1
17 15 17 2
18 5 18 1 #Down
19 10 19 1
20 19 20 2
21 19 21 1
22 19 22 1
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