ATOM 34
1 C2y C 26.0890 -17.5368
2 C1z C 25.6053 -18.8495
3 C1y C 25.5005 -16.2592
4 C2y C 27.4890 -17.5951
5 C2x C 24.3277 -19.4333
6 C1x C 26.7022 -19.7248
7 C1a C 25.2323 -20.1969
8 O2a O 26.4982 -15.1218
9 C1y C 24.1878 -15.7754
10 C1x C 27.8691 -18.9485
11 C1c C 28.3645 -16.5052
12 C2y C 23.0151 -18.9369
13 C1y C 26.4923 -13.6326
14 C1y C 22.9102 -16.3582
15 O1a O 24.2405 -14.5607
16 C1a C 29.7470 -16.7092
17 C1a C 27.8515 -15.2043
18 C1y C 22.4264 -17.6767
19 C1y C 22.0068 -19.8938
20 O2x O 27.7058 -12.9216
21 C1y C 25.2673 -12.9392
22 C1a C 21.8834 -15.4141
23 C1x C 21.0441 -17.8528
24 C1x C 20.7819 -19.2235
25 C1b C 22.1758 -21.2879
26 C1y C 27.6942 -11.5159
27 C1y C 25.2615 -11.5276
28 O1a O 24.0596 -13.6514
29 O1a O 23.4710 -21.8299
30 C1y C 26.4749 -10.8153
31 C1b C 28.9065 -10.8037
32 O1a O 24.0304 -10.8329
33 O1a O 26.4690 -9.4094
34 O1a O 30.1200 -11.4983
BOND 37
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1
6 2 7 1 #Up
7 3 8 1 #Down
8 3 9 1
9 4 10 1
10 4 11 1
11 5 12 2
12 13 8 1 #Down
13 9 14 1
14 9 15 1 #Up
15 11 16 1
16 11 17 1
17 12 18 1
18 12 19 1
19 13 20 1
20 13 21 1
21 14 22 1 #Up
22 18 23 1
23 19 24 1
24 19 25 1 #Up
25 20 26 1
26 21 27 1
27 21 28 1 #Down
28 25 29 1
29 26 30 1
30 26 31 1 #Up
31 27 32 1 #Up
32 30 33 1 #Down
33 31 34 1
34 6 10 1
35 14 18 1
36 23 24 1
37 27 30 1
|