ATOM 86
1 C1y C 17.8107 -20.5850
2 C1y C 17.7534 -21.9982
3 O2x O 16.5842 -19.8923
4 C1y C 16.6179 -22.7167
5 O2a O 19.0569 -22.6980
6 C1y C 15.3714 -20.6037
7 O2a O 16.6268 -24.1345
8 C1y C 15.3804 -22.0215
9 C1y C 19.0646 -24.1085
10 C6a C 14.1287 -19.9125
11 C1y C 15.4026 -24.8542
12 O1a O 14.1613 -22.7510
13 C1y C 20.3032 -24.8039
14 O2x O 17.8460 -24.8163
15 O6a O 14.1280 -18.4925
16 O6a O 12.9151 -20.6381
17 O2x O 14.1769 -24.1593
18 C1y C 15.4235 -26.2652
19 O2a O 21.5109 -24.0897
20 C1y C 20.3110 -26.2144
21 C1x C 17.8609 -26.2375
22 C1y C 12.9583 -24.8672
23 C1y C 14.2097 -26.9830
24 O1a O 16.6553 -26.9558
25 C1y C 22.7254 -24.7917
26 C1y C 19.0916 -26.9422
27 O1a O 21.5467 -27.0620
28 C1y C 12.9712 -26.2804
29 C1b C 11.7162 -24.1817
30 O1a O 14.2225 -28.3962
31 C1y C 23.9707 -24.0992
32 O2x O 22.7789 -26.1951
33 O1a O 19.0941 -28.3498
34 O1a O 11.7605 -27.0181
35 O1a O 11.7209 -22.7663
36 C1y C 25.1812 -24.8204
37 O1a O 24.0593 -22.7523
38 C1x C 23.9305 -26.9298
39 C1y C 25.1669 -26.2317
40 O1a O 26.4172 -24.1294
41 O1a O 26.3851 -26.9578
42 C1z C 28.8977 -16.0501
43 C1y C 27.7642 -15.3354
44 C1y C 30.1958 -15.3598
45 C1y C 28.9429 -17.4542
46 C1b C 30.1841 -16.7639
47 C2y C 26.5360 -16.0138
48 C1x C 27.7888 -13.9198
49 C1y C 30.1446 -13.9561
50 O7a O 31.4064 -16.0865
51 C1x C 27.7279 -18.1431
52 O1a O 28.9371 -18.8508
53 O1a O 30.1783 -18.1677
54 C1z C 26.5243 -17.4294
55 C2x C 25.3198 -15.3048
56 C1z C 29.0040 -13.2426
57 O7a O 31.4425 -13.2729
58 C7a C 32.6227 -15.3773
59 C1z C 25.2952 -18.1243
60 C1a C 26.5056 -18.8390
61 C1x C 24.0917 -16.0081
62 C1a C 29.6295 -12.1486
63 C1a C 28.3612 -12.2193
64 O6a O 33.8448 -16.0865
65 C1a C 32.6227 -13.9561
66 C1y C 24.0729 -17.4177
67 C1x C 25.2952 -19.5411
68 C1a C 25.9135 -16.7087
69 C1z C 22.8448 -18.1126
70 C1x C 24.0671 -20.2431
71 C1y C 22.8448 -19.5282
72 C1x C 21.6285 -17.4119
73 C1a C 22.8448 -16.7029
74 C1z C 21.6285 -20.2314
75 C1x C 20.4121 -18.1126
76 C1y C 20.4121 -19.5282
77 C1b C 22.2010 -21.4574
78 C1a C 20.9813 -21.4587
79 O2a O 19.1781 -20.2314
80 C7a C 31.4355 -11.8601
81 C2c C 32.6446 -11.1530
82 C1a C 33.8608 -11.8529
83 O6a O 30.2131 -11.1582
84 C2b C 32.6446 -9.7530
85 C1a C 31.4284 -9.0601
86 O1a O 23.4607 -21.7468
BOND 94
1 2 4 1
2 2 5 1 #Down
3 3 6 1
4 4 7 1 #Up
5 4 8 1
6 9 5 1 #Up
7 6 10 1 #Up
8 11 7 1 #Up
9 8 12 1 #Down
10 9 13 1
11 9 14 1
12 10 15 1
13 10 16 2
14 11 17 1
15 11 18 1
16 13 19 1 #Down
17 13 20 1
18 14 21 1
19 17 22 1
20 18 23 1
21 18 24 1 #Down
22 25 19 1 #Up
23 20 26 1
24 20 27 1 #Up
25 22 28 1
26 22 29 1 #Up
27 23 30 1 #Up
28 25 31 1
29 25 32 1
30 26 33 1 #Up
31 28 34 1 #Up
32 29 35 1
33 31 36 1
34 31 37 1 #Down
35 32 38 1
36 36 39 1
37 36 40 1 #Up
38 39 41 1 #Down
39 42 43 1
40 42 44 1
41 42 45 1
42 42 46 1 #Up
43 43 47 1
44 43 48 1
45 44 49 1
46 44 50 1 #Down
47 45 51 1
48 45 52 1 #Down
49 46 53 1
50 47 54 1
51 47 55 2
52 48 56 1
53 49 57 1 #Up
54 50 58 1
55 54 59 1
56 54 60 1 #Down
57 55 61 1
58 56 62 1
59 56 63 1
60 58 64 2
61 58 65 1
62 59 66 1
63 59 67 1
64 59 68 1 #Up
65 66 69 1
66 67 70 1
67 69 71 1
68 69 72 1
69 69 73 1 #Up
70 71 74 1
71 72 75 1
72 74 76 1
73 74 77 1 #Down
74 74 78 1 #Up
75 76 79 1 #Up
76 49 56 1
77 51 54 1
78 61 66 1
79 70 71 1
80 75 76 1
81 6 8 1
82 57 80 1
83 21 26 1
84 80 81 1
85 23 28 1
86 81 82 1
87 38 39 1
88 80 83 2
89 81 84 2
90 1 2 1
91 84 85 1
92 1 79 1 #Up
93 1 3 1
94 77 86 1
| 
