ATOM 88
1 C1z C 29.7561 -23.3561
2 O2a O 27.3330 -20.9786
3 O2x O 29.7561 -24.7277
4 C1x C 30.8991 -22.6703
5 C6a C 28.5674 -23.6761
6 C1y C 27.3330 -19.7442
7 C1y C 30.9449 -25.3678
8 C1y C 32.0878 -23.3561
9 C1y C 26.1899 -19.0584
10 C1y C 28.5216 -19.0584
11 C1y C 32.0878 -24.6820
12 C1c C 30.9449 -26.7394
13 O1a O 33.2308 -22.6703
14 C1y C 26.1899 -17.6868
15 O1a O 25.0013 -19.6985
16 C1y C 28.5216 -17.6868
17 O1a O 29.6647 -19.7442
18 N1b N 33.2308 -25.3678
19 C1c C 29.8018 -27.3795
20 O1a O 32.1335 -27.3795
21 O2x O 27.3330 -17.0467
22 C1b C 25.0013 -17.0467
23 O2a O 29.6647 -17.0467
24 C5a C 34.4195 -24.6820
25 O2a O 28.6588 -26.7394
26 C1b C 29.8018 -28.7054
27 C1y C 30.8077 -16.3609
28 O5a O 34.4195 -23.3103
29 C1b C 35.5625 -25.3221
30 C1z C 25.4127 -28.7054
31 O1a O 28.6588 -29.3912
32 C1y C 30.8077 -15.0351
33 C1y C 31.9964 -17.0467
34 O2x O 31.9964 -14.3493
35 C1b C 29.6647 -14.3493
36 C1y C 33.1394 -16.3609
37 O1a O 31.9506 -18.3726
38 C1y C 33.1394 -15.0351
39 O1a O 34.3281 -17.0467
40 O2a O 34.3281 -14.3493
41 C1b C 35.5168 -15.0351
42 C1c C 36.6598 -14.3035
43 C1c C 37.8485 -14.9893
44 N1b N 36.6598 -12.9777
45 C2b C 39.0373 -14.3035
46 O1a O 37.8942 -16.4067
47 C5a C 37.8028 -12.2461
48 C2b C 40.2259 -14.9893
49 O5a O 37.8028 -10.9203
50 R R 38.9915 -12.9319
51 C1b C 41.4146 -14.2578
52 C1b C 42.6034 -14.9436
53 C1b C 43.7921 -14.2578
54 C1b C 44.9808 -14.8979
55 C1b C 46.1696 -14.2121
56 C1b C 47.3582 -14.8979
57 C1b C 48.5469 -14.2121
58 C1b C 49.7357 -14.8522
59 C1b C 50.9244 -14.1664
60 C1b C 52.1131 -14.8522
61 C1b C 53.3018 -14.1664
62 C1b C 54.4905 -14.8064
63 C1a C 55.6792 -14.1206
64 O6a O 27.6073 -22.7160
65 O6a O 28.2017 -25.0021
66 O2x O 24.0868 -28.7054
67 C1x C 26.0985 -29.8484
68 C1y C 23.4010 -29.8941
69 C1y C 25.4585 -31.0371
70 C1y C 24.0868 -31.0371
71 O1a O 26.0985 -32.1801
72 C1c C 21.9837 -29.8941
73 C1c C 21.2979 -28.7054
74 C1b C 19.8805 -28.7054
75 O1a O 19.1491 -27.5167
76 O1a O 21.2979 -31.1742
77 O1a O 21.9379 -27.4709
78 N1b N 23.4010 -32.2258
79 C5a C 24.0868 -33.4602
80 C1b C 23.4010 -34.6490
81 O5a O 25.4585 -33.4602
82 C6a C 25.4127 -27.3338
83 O6a O 26.5558 -26.6480
84 O6a O 24.1783 -26.6480
85 O1a O 28.4655 -15.0150
86 O1a O 23.8342 -17.7674
87 O1a O 24.3909 -35.6389
88 O1a O 36.7749 -24.6221
BOND 91
1 1 2 1 #Down
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 6 2 1 #Up
6 3 7 1
7 4 8 1
8 6 9 1
9 6 10 1
10 7 11 1
11 7 12 1
12 8 13 1 #Down
13 9 14 1
14 9 15 1 #Up
15 10 16 1
16 10 17 1 #Down
17 11 18 1 #Up
18 12 19 1
19 12 20 1 #Down
20 14 21 1
21 14 22 1 #Up
22 16 23 1 #Up
23 18 24 1
24 19 25 1 #Up
25 19 26 1
26 27 23 1 #Down
27 24 28 2
28 24 29 1
29 30 25 1 #Down
30 26 31 1
31 27 32 1
32 27 33 1
33 32 34 1
34 32 35 1 #Up
35 33 36 1
36 33 37 1 #Up
37 34 38 1
38 36 39 1 #Down
39 38 40 1 #Up
40 8 11 1
41 16 21 1
42 36 38 1
43 40 41 1
44 41 42 1
45 42 43 1
46 42 44 1 #Down
47 43 45 1
48 43 46 1 #Up
49 44 47 1
50 45 48 2
51 47 49 2
52 47 50 1
53 48 51 1
54 51 52 1
55 52 53 1
56 53 54 1
57 54 55 1
58 55 56 1
59 56 57 1
60 57 58 1
61 58 59 1
62 59 60 1
63 60 61 1
64 61 62 1
65 62 63 1
66 5 64 1
67 5 65 2
68 30 66 1
69 30 67 1
70 66 68 1
71 67 69 1
72 68 70 1
73 69 71 1 #Down
74 69 70 1
75 68 72 1
76 72 73 1
77 73 74 1
78 74 75 1
79 72 76 1 #Down
80 73 77 1 #Up
81 70 78 1 #Up
82 78 79 1
83 79 80 1
84 79 81 2
85 30 82 1 #Up
86 82 83 1
87 82 84 2
88 35 85 1
89 22 86 1
90 80 87 1
91 29 88 1
| 
