ATOM 21
1 C8y C 21.6273 -15.0863
2 C8x C 22.8405 -15.7916
3 C8x C 24.0556 -15.0892
4 C8x C 24.0573 -13.6882
5 C8x C 22.8439 -12.9899
6 C8x C 21.6290 -13.6854
7 O6a O 13.1411 -17.2095
8 C6a C 14.3543 -17.9010
9 C1b C 15.5676 -17.2026
10 C1c C 16.7810 -17.8939
11 C5a C 17.9873 -17.1955
12 N1b N 19.2005 -17.8867
13 C1c C 20.4139 -17.1884
14 C7a C 21.6273 -17.8798
15 O7a O 22.8405 -17.1814
16 C1a C 24.0539 -17.8727
17 O6a O 14.3473 -19.3046
18 N1a N 16.7739 -19.2977
19 O5a O 17.9802 -15.7916
20 O6a O 21.6202 -19.2835
21 C1b C 20.4139 -15.7916
BOND 21
1 10 11 1
2 5 6 2
3 11 12 1
4 6 1 1
5 12 13 1
6 13 14 1
7 1 2 2
8 14 15 1
9 7 8 1
10 15 16 1
11 2 3 1
12 8 17 2
13 8 9 1
14 10 18 1 #Up
15 3 4 2
16 11 19 2
17 9 10 1
18 14 20 2
19 4 5 1
20 13 21 1 #Up
21 21 1 1
|