ATOM 23
1 C8x C 11.3400 -17.0100
2 C8x C 11.3400 -15.6100
3 C8x C 12.5300 -14.9100
4 C8y C 13.7900 -15.6100
5 C8y C 13.7900 -17.0100
6 C8y C 12.5300 -17.7100
7 C5x C 14.9800 -14.9100
8 C2y C 16.1700 -15.6100
9 C2x C 16.1700 -17.0100
10 C5x C 14.9800 -17.7100
11 O5x O 14.9800 -19.1100
12 O5x O 14.9800 -13.5100
13 C1b C 17.3600 -14.9100
14 C2b C 18.6200 -15.6100
15 C2c C 19.8100 -14.9100
16 C1b C 21.0000 -15.6100
17 C1b C 22.2600 -14.9100
18 C2b C 23.4500 -15.6100
19 C2c C 24.6400 -14.9100
20 C1a C 25.9000 -15.6100
21 C1a C 19.8100 -13.5100
22 C1a C 24.6400 -13.5100
23 C1a C 12.5300 -19.1100
BOND 24
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 1
12 10 11 2
13 7 12 2
14 8 13 1
15 13 14 1
16 14 15 2
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 2
21 19 20 1
22 15 21 1
23 19 22 1
24 6 23 1
BRACKET 1 17.1500 -15.9600 17.1500 -13.3000
1 21.7700 -13.3000 21.7700 -15.9600
1 n
ORIGINAL 1 13 14 15 16 21
REPEAT 1
|