ATOM 94
1 O7a O 27.9841 -21.6513
2 C1b C 29.1969 -20.9512
3 C7a C 26.7714 -20.9512
4 C1y C 31.2973 -22.1639
5 C1y C 32.6976 -22.1639
6 C1y C 33.3978 -20.9512
7 C1y C 32.6976 -19.7384
8 O2x O 31.2973 -19.7384
9 C1y C 30.5972 -20.9512
10 C8y C 26.6579 -16.2233
11 C8x C 26.6579 -17.6236
12 C8y C 27.8735 -18.3237
13 C8x C 27.8735 -15.5231
14 C8y C 29.0820 -16.2233
15 C8y C 29.0760 -17.6236
16 C8x C 30.2857 -18.3288
17 C8y C 31.5013 -17.6339
18 C8y C 31.5075 -16.2336
19 O2x O 30.2978 -15.5282 #+
20 C8y C 32.7231 -15.5386
21 C8x C 33.9290 -16.2472
22 C8y C 35.1447 -15.5523
23 C8y C 35.1508 -14.1520
24 C8y C 33.9411 -13.4466
25 C8x C 32.6553 -14.1417
26 O1a O 36.3664 -13.4570
27 O1a O 36.3543 -16.2575
28 O2a O 32.7110 -18.3391
29 O6a O 26.7714 -19.5509
30 C1b C 25.5588 -21.6513
31 C7a C 24.3461 -20.9512
32 O7a O 23.1334 -21.6513
33 O6a O 24.3461 -19.5509
34 C1c C 23.1218 -23.0479
35 C1c C 21.9033 -23.7380
36 C6a C 24.3286 -23.7580
37 O6a O 24.3871 -25.1583
38 O6a O 25.5471 -23.0679
39 C6a C 20.6965 -23.0278
40 O1a O 21.8918 -25.1381
41 O6a O 20.7080 -21.6276
42 O6a O 19.4780 -23.7178
43 O2a O 25.4456 -15.5224
44 C1y C 24.2325 -16.2219
45 O2x O 23.0259 -15.5240
46 C1y C 21.8128 -16.2236
47 C1y C 21.8121 -17.6239
48 C1y C 23.0246 -18.3246
49 C1y C 24.2375 -17.6251
50 O1a O 25.4514 -18.3234
51 O1a O 23.0237 -19.7248
52 O1a O 20.5991 -18.3234
53 C1b C 20.6006 -15.5228
54 O7a O 19.3875 -16.2222
55 C7a C 18.1751 -15.5214
56 O6a O 18.1760 -14.1211
57 C2b C 16.9622 -16.2211
58 C2b C 16.9614 -17.6213
59 C8y C 15.7483 -18.3208
60 C8x C 14.5416 -17.6197
61 C8y C 13.3286 -18.3191
62 C8y C 13.3279 -19.7194
63 C8x C 14.5401 -20.4202
64 C8x C 15.7532 -19.7208
65 O1a O 12.1148 -20.4191
66 O1a O 12.1162 -17.6185
67 O2a O 34.7981 -20.9512
68 C1y C 35.4982 -22.1639
69 O2x O 34.7981 -23.3765
70 C1y C 35.4982 -24.5892
71 C1y C 36.8985 -24.5892
72 C1y C 37.5987 -23.3765
73 C1y C 36.8985 -22.1639
74 C1b C 34.7981 -25.8020
75 O1a O 33.3978 -25.8020
76 O1a O 37.5987 -25.8020
77 O1a O 38.9990 -23.3765
78 O7a O 37.5987 -20.9512
79 C7a C 38.9990 -20.9512
80 C2b C 39.6991 -22.1639
81 O6a O 38.9847 -19.5471
82 C2b C 41.0994 -22.1639
83 C8y C 41.7995 -23.3765
84 C8x C 41.0945 -24.5821
85 C8y C 41.7946 -25.7948
86 C8y C 43.1949 -25.7948
87 C8x C 43.8951 -24.5821
88 C8x C 43.1949 -23.3695
89 O1a O 43.8951 -27.0076
90 O1a O 41.0945 -27.0076
91 O1a O 30.5972 -23.3765
92 O1a O 27.8769 -19.7240
93 O1a O 33.3978 -23.3765
94 O1a O 33.9470 -12.0463
BOND 101
1 24 25 2
2 25 20 1
3 14 13 2
4 23 26 1
5 13 10 1
6 44 45 1
7 45 46 1
8 46 47 1
9 47 48 1
10 48 49 1
11 49 44 1
12 22 27 1
13 49 50 1 #Down
14 5 6 1
15 48 51 1 #Up
16 47 52 1 #Down
17 6 7 1
18 46 53 1 #Up
19 7 8 1
20 53 54 1
21 8 9 1
22 54 55 1
23 9 4 1
24 55 56 2
25 1 2 1
26 55 57 1
27 57 58 2
28 58 59 1
29 14 15 1
30 59 60 2
31 60 61 1
32 61 62 2
33 62 63 1
34 63 64 2
35 64 59 1
36 17 28 1
37 62 65 1
38 7 28 1 #Up
39 61 66 1
40 9 2 1 #Up
41 6 67 1 #Down
42 15 16 1
43 68 67 1 #Up
44 3 29 2
45 16 17 2
46 3 30 1
47 17 18 1
48 30 31 1
49 68 69 1
50 69 70 1
51 70 71 1
52 71 72 1
53 72 73 1
54 73 68 1
55 18 19 2
56 70 74 1 #Up
57 31 32 1
58 74 75 1
59 19 14 1
60 71 76 1 #Down
61 31 33 2
62 72 77 1 #Up
63 73 78 1 #Down
64 32 34 1
65 78 79 1
66 18 20 1
67 79 80 1
68 34 35 1
69 79 81 2
70 1 3 1
71 80 82 2
72 34 36 1
73 82 83 1
74 4 5 1
75 36 37 1
76 10 11 2
77 36 38 2
78 11 12 1
79 83 84 2
80 84 85 1
81 85 86 2
82 86 87 1
83 87 88 2
84 88 83 1
85 35 39 1
86 86 89 1
87 12 15 2
88 85 90 1
89 5 93 1 #Up
90 35 40 1
91 4 91 1 #Up
92 20 21 2
93 39 41 2
94 21 22 1
95 39 42 1
96 22 23 2
97 10 43 1
98 23 24 1
99 12 92 1
100 44 43 1 #Up
101 24 94 1
| 
