ATOM 63
1 C1y C 39.5115 -15.7349
2 C1y C 39.5115 -17.1338
3 O2x O 40.7005 -15.0355
4 C1y C 40.7005 -17.7633
5 C1y C 41.8896 -15.7349
6 C1y C 41.8896 -17.1338
7 O1a O 40.7005 -19.1622
8 C1b C 43.0786 -15.0355
9 O1a O 43.0786 -17.7633
10 C1y C 15.7308 -25.2472
11 C1y C 15.7309 -26.6461
12 O2x O 14.4718 -24.5478
13 C1y C 14.4718 -27.2756
14 O1a O 16.8499 -27.3455
15 C1y C 13.2828 -25.2472
16 C1y C 13.2828 -26.5761
17 O1a O 14.4718 -28.6744
18 C1a C 12.1637 -24.5478
19 O1a O 12.0938 -27.2756
20 C1y C 20.4869 -22.5894
21 C1y C 20.4869 -23.9882
22 O2x O 19.3678 -21.8200
23 C1y C 19.2979 -24.6177
24 O1a O 21.6760 -24.6877
25 C1y C 18.1089 -22.5194
26 C1y C 18.1089 -23.9183
27 O1a O 19.2979 -26.0166
28 C1b C 16.9898 -21.8200
29 O2a O 16.9198 -24.5478
30 C1z C 28.8801 -17.7633
31 C1y C 28.8801 -19.1622
32 C1y C 30.0692 -17.1338
33 C1x C 27.6911 -17.0639
34 C1a C 28.8801 -16.4344
35 C1y C 27.6911 -19.8616
36 C1x C 31.1882 -19.1622
37 C1y C 31.1882 -17.8332
38 C1y C 30.0692 -15.7349
39 C1x C 26.5021 -17.7633
40 C1y C 26.5021 -19.1622
41 C1x C 27.6911 -21.1905
42 O2x O 32.3773 -17.1338
43 C1z C 32.3773 -15.7349
44 C1a C 29.0899 -14.7557
45 C1z C 25.3130 -19.7917
46 C2x C 26.5021 -21.8899
47 C1b C 33.5663 -15.0355
48 O1a O 32.3773 -14.4060
49 C2y C 25.3130 -21.1905
50 C1x C 24.1240 -19.1622
51 C1a C 25.3130 -18.4627
52 C1b C 34.7553 -15.7349
53 C1x C 24.1240 -21.8899
54 C1x C 22.9349 -19.7917
55 C1c C 35.9444 -15.0355
56 C1y C 22.9349 -21.1905
57 C1b C 37.1334 -15.7349
58 C1a C 35.9444 -13.7066
59 O2a O 21.7459 -21.8899
60 O2a O 38.3225 -15.0355
61 O1a O 44.2809 -15.7171
62 O1a O 38.2819 -17.8742
63 O1a O 15.7726 -22.4948
BOND 70
1 1 3 1
2 2 4 1
3 3 5 1
4 4 6 1
5 4 7 1 #Down
6 5 8 1 #Down
7 6 9 1 #Up
8 5 6 1
9 11 14 1 #Down
10 12 15 1
11 13 16 1
12 13 17 1 #Down
13 15 18 1 #Down
14 16 19 1 #Up
15 20 21 1
16 20 22 1
17 21 23 1
18 21 24 1 #Down
19 22 25 1
20 23 26 1
21 23 27 1 #Up
22 25 28 1 #Up
23 26 29 1 #Down
24 25 26 1
25 15 16 1
26 10 11 1
27 10 12 1
28 11 13 1
29 30 31 1
30 30 32 1
31 30 33 1
32 30 34 1 #Up
33 31 35 1
34 31 36 1
35 32 37 1
36 32 38 1
37 33 39 1
38 35 40 1
39 35 41 1
40 37 42 1
41 38 43 1
42 38 44 1 #Down
43 40 45 1
44 41 46 1
45 43 47 1
46 43 48 1 #Down
47 45 49 1
48 45 50 1
49 45 51 1 #Up
50 47 52 1
51 49 53 1
52 50 54 1
53 52 55 1
54 53 56 1
55 55 57 1
56 55 58 1 #Down
57 56 59 1 #Up
58 36 37 1
59 39 40 1
60 42 43 1
61 46 49 2
62 54 56 1
63 20 59 1 #Up
64 10 29 1 #Up
65 57 60 1
66 1 60 1 #Down
67 1 2 1
68 8 61 1
69 2 62 1 #Up
70 28 63 1
| 
