ATOM 42
1 C1z C 28.1755 -16.8626
2 C2y C 27.0490 -16.1448
3 C1x C 28.2338 -18.2575
4 C1x C 29.4653 -16.1797
5 C6a C 29.4536 -17.5571
6 C2y C 25.8291 -16.8276
7 C2y C 26.9964 -14.7498
8 C1x C 27.0139 -18.9345
9 C1x C 29.4827 -14.7848
10 O6a O 30.6675 -16.8509
11 O6a O 29.4477 -18.9579
12 C1z C 25.8117 -18.2284
13 C2x C 24.6210 -16.1155
14 C1y C 28.2863 -14.0727
15 C1a C 25.8642 -14.0319
16 C1z C 24.6035 -18.9171
17 C1a C 25.8000 -19.6232
18 C1x C 23.4070 -16.8100
19 C1a C 28.3039 -12.6719
20 C1y C 23.3954 -18.2108
21 C1x C 24.6035 -20.3179
22 C1a C 25.1459 -17.5046
23 C1z C 22.1755 -18.9054
24 C1x C 23.3837 -21.0182
25 C1y C 22.1696 -20.3062
26 C1x C 20.9673 -18.2050
27 C1a C 22.1638 -17.4987
28 C1z C 20.9673 -21.0123
29 C1x C 19.7475 -18.9054
30 C1y C 19.7475 -20.3062
31 C1a C 20.2494 -22.4305
32 C1a C 21.6033 -22.3664
33 O2a O 18.5334 -21.0123
34 C1y C 17.8179 -22.2166
35 O2x O 16.6964 -21.3725
36 C1y C 17.3544 -23.5341
37 C1y C 15.5520 -22.1729
38 C1y C 15.9567 -23.5135
39 O1a O 17.8888 -24.8266
40 O1a O 14.8354 -24.3641
41 C1b C 14.3396 -21.4729
42 O1a O 13.1277 -22.1726
BOND 47
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 2
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 2
11 6 12 1
12 6 13 2
13 7 14 1
14 7 15 1
15 12 16 1
16 12 17 1 #Down
17 13 18 1
18 14 19 1 #Up
19 16 20 1
20 16 21 1
21 16 22 1 #Up
22 20 23 1
23 21 24 1
24 23 25 1
25 23 26 1
26 23 27 1 #Up
27 25 28 1
28 26 29 1
29 28 30 1
30 28 31 1
31 28 32 1
32 30 33 1 #Up
33 34 33 1 #Up
34 34 35 1
35 34 36 1
36 35 37 1
37 38 36 1
38 36 39 1 #Down
39 38 40 1 #Up
40 8 12 1
41 9 14 1
42 18 20 1
43 24 25 1
44 29 30 1
45 37 38 1
46 37 41 1 #Up
47 41 42 1
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