ATOM 51
1 C2b C 20.2681 -18.3863
2 C1a C 21.1278 -17.3417
3 C1x C 23.2010 -22.2962
4 C1y C 22.2696 -21.7345
5 C1y C 21.8514 -20.2247
6 C1y C 22.4714 -19.0115
7 C1x C 23.7670 -18.6130
8 C1y C 24.9785 -19.2304
9 C8y C 25.4036 -20.5411
10 C8y C 24.7765 -21.7434
11 N4x N 26.7505 -20.7590
12 C8y C 26.9547 -22.1174
13 C8y C 25.7323 -22.7133
14 C8x C 25.6460 -24.0609
15 C8x C 26.7818 -24.8268
16 C8x C 27.9899 -24.2240
17 C8x C 28.0834 -22.8762
18 N1x N 20.9836 -22.0016
19 C1x C 20.1840 -20.8925
20 C2y C 20.7479 -19.6469
21 C7a C 22.5149 -20.4979
22 O7a O 23.2780 -21.6563
23 C1a C 24.2388 -20.4051
24 O6a O 23.2692 -19.4457
25 C1z C 31.3549 -17.9605
26 C1y C 32.1018 -17.0983
27 C1x C 32.3581 -18.9055
28 C1y C 33.2618 -17.8410
29 C1y C 34.0920 -17.1108
30 C1x C 35.1645 -17.8573
31 C1b C 34.5060 -15.5924
32 C8y C 28.2141 -17.3705
33 N4x N 29.3866 -19.0203
34 C8y C 28.2154 -18.6177
35 C8x C 27.1316 -16.7476
36 C8x C 27.1316 -19.2477
37 C8y C 26.0582 -17.3705
38 C8y C 26.0582 -18.6177
39 C8y C 30.1192 -18.0192
40 C8y C 29.4078 -17.0072
41 C1x C 29.7604 -15.8099
42 C1x C 30.9071 -15.3352
43 N1y N 31.9889 -15.9359
44 C1x C 32.8860 -14.2573
45 C7a C 31.4858 -19.4908
46 O7a O 32.4520 -20.4572
47 C1a C 32.5124 -21.9304
48 O6a O 30.5024 -20.4035
49 C1a C 35.9074 -15.2633
50 O2a O 24.9856 -16.7544
51 C1a C 24.9704 -15.0581
BOND 59
1 21 24 2
2 6 5 1 #Up
3 6 7 1
4 7 8 1
5 8 9 1
6 10 3 1
7 12 13 2
8 13 14 1
9 14 15 2
10 15 16 1
11 16 17 2
12 17 12 1
13 4 18 1
14 1 2 1
15 18 19 1
16 3 4 1
17 19 20 1
18 20 6 1
19 1 20 2
20 9 10 2
21 10 13 1
22 5 21 1
23 12 11 1
24 21 22 1
25 27 28 1
26 29 30 1
27 25 26 1
28 25 27 1
29 26 29 1
30 40 32 1
31 39 33 1
32 32 34 1
33 32 35 2
34 34 36 2
35 35 37 1
36 36 38 1
37 33 34 1
38 37 38 2
39 39 40 2
40 40 41 1
41 39 25 1
42 41 42 1
43 42 43 1
44 26 43 1
45 43 44 1 #Up
46 25 45 1 #Down
47 45 46 1
48 46 47 1
49 45 48 2
50 28 44 1 #Up
51 28 30 1
52 31 49 1
53 29 31 1 #Up
54 11 9 1
55 22 23 1
56 37 50 1
57 4 5 1 #Up
58 50 51 1
59 38 8 1
| 
