ATOM 23
1 C1x C 22.8372 -20.2179
2 C1z C 23.9963 -19.4243
3 C1y C 22.7314 -18.8264
4 C1y C 25.4759 -15.2571
5 C2x C 25.4759 -16.6568
6 C2y C 26.7357 -17.3567
7 C1y C 27.9255 -16.6568
8 C1y C 27.9255 -15.2571
9 C1x C 26.7357 -14.5572
10 C1x C 29.2553 -17.0767
11 C1x C 30.0951 -15.9569
12 C5x C 29.2553 -14.8371
13 O5x O 29.6752 -13.5074
14 C5a C 26.7357 -18.7564
15 N1b N 25.4759 -19.4563
16 O5a O 27.9255 -19.4563
17 C1b C 24.2862 -14.5572
18 C1a C 23.0964 -15.2571
19 C6a C 24.3112 -18.0903
20 O6a O 23.3215 -17.1005
21 O6a O 25.6427 -17.7115
22 C1b C 21.9431 -17.6802
23 C1a C 20.5792 -17.7887
BOND 25
1 1 2 1
2 2 3 1
3 3 1 1
4 4 5 1
5 5 6 2
6 6 7 1
7 7 8 1
8 8 9 1
9 4 9 1
10 7 10 1
11 10 11 1
12 11 12 1
13 8 12 1
14 12 13 2
15 6 14 1
16 14 15 1
17 14 16 2
18 4 17 1 #Down
19 17 18 1
20 2 15 1 #Up
21 2 19 1 #Down
22 19 20 1
23 19 21 2
24 3 22 1 #Down
25 22 23 1
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