 ATOM 24
1 C8y C 25.2112 -26.7860
2 C8y C 26.4311 -26.0881
3 C8y C 25.2052 -28.1880
4 C8x C 24.0030 -26.0822
5 C1c C 26.4370 -24.6862
6 C8x C 27.6452 -26.7978
7 C8x C 24.0030 -28.8916
8 N5x N 26.4194 -28.8976
9 C8y C 22.7829 -26.7860
10 C1y C 27.6570 -23.9883
11 O1a O 25.2229 -23.9766
12 C8x C 27.6394 -28.1995
13 C8x C 22.7829 -28.1880
14 O2a O 21.5688 -26.0822
15 N1y N 29.0942 -23.1144
16 C1x C 26.9239 -22.9443
17 C1a C 21.5688 -24.6804
18 C1x C 29.0942 -21.8710
19 C1x C 30.5956 -23.9179
20 C1y C 28.3373 -22.1055
21 C1y C 28.3433 -21.1202
22 C1x C 29.8977 -22.8094
23 C2b C 27.8095 -19.8181
24 C2a C 28.6718 -18.7094
BOND 27
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 5 11 1 #Down
11 6 12 1
12 7 13 2
13 9 14 1
14 10 15 1
15 10 16 1
16 14 17 1
17 15 18 1
18 15 19 1
19 16 20 1
20 18 21 1
21 19 22 1
22 21 23 1 #Up
23 23 24 2
24 8 12 2
25 9 13 1
26 20 21 1
27 20 22 1
|