ATOM 20
1 N4y N 24.4030 -15.9695
2 C8y C 23.1040 -15.5559
3 C1y C 23.5235 -17.8700
4 C8x C 25.2127 -14.8771
5 C8y C 23.1040 -14.1798
6 N5x N 21.9114 -16.2463
7 O2x O 22.4195 -17.0791
8 C1y C 23.1040 -19.1761
9 N5x N 24.4088 -13.7547
10 C8y C 21.9114 -13.5011
11 C8x C 20.7362 -15.5559
12 C1y C 21.3274 -17.8700
13 C1y C 21.7339 -19.1761
14 O1a O 23.9078 -20.2741
15 N4x N 20.7362 -14.1798
16 O5x O 21.9056 -12.1426
17 C6a C 20.0400 -17.4447
18 O1a O 20.9372 -20.2682
19 O6a O 19.0237 -18.3547
20 O6a O 19.3400 -16.2322
BOND 22
1 1 2 1
2 3 1 1 #Up
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 6 11 2
11 7 12 1
12 8 13 1
13 8 14 1 #Down
14 10 15 1
15 10 16 2
16 12 17 1 #Up
17 13 18 1 #Down
18 17 19 1
19 5 9 1
20 11 15 1
21 12 13 1
22 17 20 2
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