ATOM 17
1 C1b C 17.0100 -20.8600
2 C1c C 18.2224 -21.5600
3 N1b N 19.4349 -20.8600
4 C5a C 20.6473 -21.5600
5 C1b C 21.8597 -20.8600
6 C1b C 23.0722 -21.5600
7 C3b C 15.7976 -21.5600
8 N3a N 14.5851 -22.2600
9 C6a C 18.2224 -22.9598
10 O6a O 16.9932 -23.6697
11 O6a O 19.4180 -23.6502
12 O5a O 20.6473 -22.9600
13 C1c C 24.3124 -20.8600
14 C6a C 25.5249 -21.5600
15 N1a N 24.3193 -19.4603
16 O6a O 26.7560 -20.8490
17 O6a O 25.5250 -22.9598
BOND 16
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 7 1
7 7 8 3
8 2 9 1 #Down
9 9 10 1
10 9 11 2
11 4 12 2
12 6 13 1
13 13 14 1
14 13 15 1 #Down
15 14 16 1
16 14 17 2
|