ATOM 20
1 O6a O 13.5857 -18.4148
2 C6a C 14.7989 -17.7144
3 C1c C 16.0121 -18.4148
4 C1b C 17.2252 -17.7144
5 C1b C 18.4384 -18.4148
6 C5a C 19.6516 -17.7144
7 N1b N 20.8648 -18.4148
8 C1c C 22.0779 -17.7144
9 C5a C 23.2911 -18.4148
10 N1b N 24.5043 -17.7144
11 C1b C 25.7175 -18.4148
12 C5a C 26.9306 -17.7144
13 N1a N 28.1438 -18.4148
14 O6a O 14.7989 -16.3137
15 N1a N 16.0121 -19.8154
16 O5a O 19.6516 -16.3138
17 C1b C 22.0779 -16.3136
18 S1a S 23.2783 -15.6205
19 O5a O 23.2911 -19.8153
20 O5a O 26.9306 -16.3139
BOND 19
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 2 14 2
14 3 15 1 #Down
15 6 16 2
16 8 17 1 #Up
17 17 18 1
18 9 19 2
19 12 20 2
| 
