ATOM 46
1 C1y C 20.1631 -33.1420
2 O2x O 18.9813 -32.4571
3 C1y C 20.1582 -34.5154
4 C1y C 17.7928 -33.1376
5 C1y C 18.9614 -35.1980
6 O1a O 21.3368 -35.2052
7 C1y C 17.7828 -34.5080
8 C1b C 16.6038 -32.4417
9 O1a O 18.9625 -36.5615
10 O1a O 16.5920 -35.1806
11 O1a O 16.6138 -31.0714
12 C1z C 26.1255 -29.7216
13 C1z C 24.9349 -30.3987
14 C1y C 27.2987 -30.4104
15 C1x C 24.9290 -29.0212
16 C1x C 26.1372 -28.3501
17 C1y C 24.9290 -31.7645
18 C1x C 23.7500 -29.7159
19 C1z C 28.4835 -29.7276
20 C1x C 27.2987 -31.7762
21 C1x C 27.3220 -27.6730
22 C1z C 23.7500 -32.4532
23 C1x C 26.1138 -32.4532
24 C1x C 22.5709 -30.3987
25 C1z C 28.5012 -28.3675
26 C1x C 30.8416 -29.7567
27 C1a C 28.4719 -31.0991
28 C1y C 22.5709 -31.7645
29 C6a C 24.5029 -33.8598
30 C1a C 23.0554 -33.6264
31 C1y C 29.6860 -27.7021
32 C1a C 28.4952 -26.9960
33 C1x C 30.8592 -28.3968
34 O2a O 21.3803 -32.4532
35 O6a O 26.0964 -33.8598
36 O6a O 23.7033 -35.2373
37 C1c C 29.6918 -26.3363
38 C1y C 30.8766 -25.6593
39 C1a C 28.5128 -25.6476
40 O7x O 30.8766 -24.2935
41 C1x C 32.0615 -26.3423
42 C7x C 32.0674 -23.6107
43 C2x C 33.2406 -25.6593
44 C2y C 33.2406 -24.2935
45 O6a O 32.0674 -22.2462
46 C1a C 34.4312 -23.6107
BOND 52
1 1 3 1
2 2 4 1
3 3 5 1
4 3 6 1 #Down
5 4 7 1
6 4 8 1 #Up
7 5 9 1 #Up
8 7 10 1 #Down
9 8 11 1
10 5 7 1
11 1 2 1
12 12 13 1
13 12 14 1
14 12 15 1 #Up
15 12 16 1
16 13 17 1
17 13 18 1
18 14 19 1
19 14 20 1
20 16 21 1
21 17 22 1
22 17 23 1
23 18 24 1
24 19 25 1
25 19 26 1
26 19 27 1 #Down
27 22 28 1
28 22 29 1 #Down
29 22 30 1 #Up
30 25 31 1
31 25 32 1 #Up
32 26 33 1
33 28 34 1 #Up
34 29 35 1
35 29 36 2
36 31 37 1
37 37 38 1
38 37 39 1 #Down
39 38 40 1
40 38 41 1
41 40 42 1
42 41 43 1
43 42 44 1
44 42 45 2
45 44 46 1
46 13 15 1 #Up
47 20 23 1
48 21 25 1
49 24 28 1
50 31 33 1
51 43 44 2
52 1 34 1 #Up
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