ATOM 66
1 C1y C 25.4998 -14.4942
2 C1y C 25.4998 -13.1032
3 O2x O 26.6987 -15.1933
4 C1x C 26.6987 -12.4100
5 O7a O 24.3020 -12.4100
6 C8y C 27.9604 -14.4884
7 C8y C 27.8963 -13.1092
8 C7a C 24.3020 -11.0194
9 C8x C 29.0882 -15.1933
10 C8y C 29.0999 -12.4160
11 C8y C 23.0844 -10.3332
12 O6a O 25.4998 -10.3332
13 C8y C 30.2801 -14.5001
14 C8x C 30.2858 -13.1149
15 O1a O 29.1128 -11.0311
16 C8x C 23.0972 -8.9683
17 C8x C 21.9055 -11.0252
18 O1a O 31.4718 -15.2050
19 C8y C 21.8925 -8.2685
20 C8y C 20.7008 -10.3332
21 C8y C 20.7008 -8.9683
22 O1a O 21.8925 -6.8840
23 O1a O 19.4970 -11.0252
24 O1a O 19.4970 -8.2685
25 C8y C 24.3020 -15.1874
26 C1y C 25.2411 -19.8645
27 C8y C 26.4453 -19.1722
28 C1y C 25.2353 -21.2553
29 O2x O 24.0490 -19.1727
30 C1x C 24.0304 -21.9427
31 O7a O 26.4328 -21.9544
32 C8y C 22.8444 -19.8588
33 C8y C 22.8385 -21.2436
34 C7a C 26.4270 -23.3395
35 C8x C 21.6396 -19.1668
36 C8y C 21.6396 -21.9427
37 C8y C 27.6245 -24.0372
38 O6a O 25.2294 -24.0255
39 C8y C 20.4422 -19.8588
40 C8x C 20.4422 -21.2436
41 O1a O 21.6396 -23.3278
42 C8x C 27.6187 -25.4163
43 C8x C 28.8294 -23.3452
44 O1a O 19.2442 -19.1668
45 C8y C 28.8108 -26.1212
46 C8y C 30.0213 -24.0372
47 C8y C 30.0156 -25.4280
48 O1a O 28.8050 -27.5062
49 O1a O 31.2319 -23.3512
50 O1a O 31.2261 -26.1271
51 C8y C 26.4516 -17.8004
52 C8y C 24.3020 -16.5782
53 C8y C 27.6550 -17.1074
54 C8y C 23.0972 -17.2642
55 C8x C 27.6433 -19.8762
56 C8y C 28.8469 -17.8121
57 O1a O 27.6610 -15.7224
58 C8x C 23.0972 -14.4942
59 C8y C 21.8925 -16.5782
60 O1a O 23.0972 -18.6482
61 C8y C 28.8411 -19.1973
62 O1a O 30.0517 -17.1191
63 C8y C 21.8925 -15.1874
64 O1a O 20.6950 -17.2642
65 O1a O 30.0330 -19.8949
66 O1a O 20.6950 -14.4884
BOND 73
1 10 15 1
2 11 16 2
3 11 17 1
4 13 18 1
5 16 19 1
6 17 20 2
7 19 21 2
8 19 22 1
9 20 23 1
10 21 24 1
11 6 7 2
12 13 14 1
13 20 21 1
14 1 25 1 #Down
15 1 2 1
16 1 3 1
17 2 4 1
18 2 5 1 #Down
19 3 6 1
20 4 7 1
21 5 8 1
22 6 9 1
23 7 10 1
24 8 11 1
25 8 12 2
26 9 13 2
27 10 14 2
28 35 39 2
29 36 40 2
30 36 41 1
31 37 42 2
32 37 43 1
33 39 44 1
34 42 45 1
35 43 46 2
36 45 47 2
37 45 48 1
38 46 49 1
39 47 50 1
40 32 33 2
41 39 40 1
42 46 47 1
43 26 27 1 #Down
44 26 28 1
45 26 29 1
46 28 30 1
47 28 31 1 #Down
48 29 32 1
49 30 33 1
50 31 34 1
51 32 35 1
52 33 36 1
53 34 37 1
54 34 38 2
55 51 52 1
56 51 27 1
57 51 53 2
58 52 25 2
59 52 54 1
60 27 55 2
61 53 56 1
62 53 57 1
63 25 58 1
64 54 59 2
65 54 60 1
66 55 61 1
67 56 62 1
68 58 63 2
69 59 64 1
70 61 65 1
71 63 66 1
72 56 61 2
73 59 63 1
|