ATOM 69
1 C7a C 24.9204 -16.7897
2 C1b C 26.1342 -17.4835
3 C1c C 27.3390 -16.7782
4 C1b C 28.5509 -17.4712
5 C1b C 29.7557 -16.7660
6 C1b C 30.9677 -17.4590
7 C1b C 32.1725 -16.7538
8 C1b C 33.3844 -17.4466
9 C1b C 34.5892 -16.7414
10 C1b C 35.8012 -17.4342
11 C1b C 37.0060 -16.7290
12 O7a O 27.4019 -15.3800
13 C7a C 28.6092 -14.6748
14 C1b C 28.6021 -13.2768
15 C1c C 29.8095 -12.5714
16 C1b C 29.8024 -11.1734
17 O6a O 29.8235 -15.3678
18 C1a C 31.0238 -13.2644
19 C6a C 28.5879 -10.4804
20 O6a O 28.5808 -9.0822
21 O6a O 27.3805 -11.1856
22 C1c C 38.2210 -17.4210
23 C1a C 39.4277 -16.7148
24 C1a C 38.2293 -18.8190
25 O6a O 24.9110 -15.3849
26 O7a O 23.7133 -17.4954
27 C1y C 27.2451 -23.7786
28 N4y N 28.5833 -23.3346
29 O2x O 26.1523 -22.9723
30 C1y C 26.8302 -25.1521
31 C8y C 29.6352 -24.2696
32 C8x C 28.8755 -21.9671
33 C1y C 25.0068 -23.8079
34 C1y C 25.4276 -25.1521
35 O1a O 27.6542 -26.2800
36 N4x N 30.9794 -23.8313
37 O5x O 29.3607 -25.6429
38 C8x C 30.2021 -21.5169
39 C1c C 23.6744 -23.3754
40 O1a O 24.5977 -26.2740
41 C8y C 31.2599 -22.4521
42 O5x O 32.5982 -22.0196
43 C1y C 19.4662 -26.0447
44 C1y C 20.8582 -26.0595
45 C1y C 21.3024 -24.7401
46 O2x O 20.1848 -23.9103
47 C1y C 19.0502 -24.7164
48 O2a O 21.5979 -27.1994
49 O1a O 18.6324 -27.1672
50 C1b C 17.7250 -24.2703
51 O2a O 22.6367 -24.3220
52 S4a S 21.6589 -28.5971
53 O1d O 20.2607 -28.6599
54 O1d O 23.0571 -28.5971
55 O1d O 21.6518 -29.9952
56 C1y C 22.0189 -19.1514
57 C1y C 23.3890 -18.8553
58 C1x C 24.4852 -19.7440
59 N1y N 21.3952 -20.4174
60 N1y N 24.4791 -21.1499
61 C5x C 21.9970 -21.6930
62 C1y C 23.3696 -22.0139
63 C1a C 25.7339 -21.7666
64 O5x O 21.1181 -22.7804
65 C1a C 19.9970 -20.4057
66 C6a C 21.1585 -18.0493
67 O6a O 21.6827 -16.7531
68 O6a O 19.7738 -18.0335
69 N1a N 16.6763 -25.1948
BOND 72
1 27 29 1
2 27 30 1
3 28 31 1
4 28 32 1
5 29 33 1
6 30 34 1
7 30 35 1 #Down
8 31 36 1
9 31 37 2
10 32 38 2
11 33 39 1 #Up
12 34 40 1 #Down
13 36 41 1
14 41 42 2
15 33 34 1
16 38 41 1
17 6 7 1
18 15 16 1
19 7 8 1
20 8 9 1
21 9 10 1
22 10 11 1
23 13 17 2
24 1 25 2
25 1 26 1
26 15 18 1
27 16 19 1
28 19 20 2
29 19 21 1
30 11 22 1
31 22 23 1
32 22 24 1
33 1 2 1
34 2 3 1
35 3 4 1
36 4 5 1
37 3 12 1
38 12 13 1
39 43 44 1
40 52 53 2
41 44 45 1
42 52 54 2
43 43 49 1 #Down
44 52 55 1
45 47 50 1 #Up
46 45 46 1
47 46 47 1
48 47 43 1
49 45 51 1 #Up
50 44 48 1 #Down
51 48 52 1
52 56 57 1
53 39 51 1
54 61 64 2
55 57 58 1
56 56 59 1
57 59 65 1
58 58 60 1
59 59 61 1
60 60 63 1
61 62 39 1
62 60 62 1
63 61 62 1
64 57 26 1
65 5 6 1
66 56 66 1
67 13 14 1
68 66 67 1
69 14 15 1
70 66 68 2
71 27 28 1 #Up
72 50 69 1
| 
