ATOM 48
1 C1z C 27.5035 -15.7995
2 C1y C 27.5035 -17.1453
3 C1y C 27.4918 -14.4711
4 C1y C 28.4647 -15.0304
5 C1y C 26.3557 -15.1411
6 C1z C 26.3557 -17.8037
7 C1y C 28.5113 -17.9377
8 C1z C 29.7697 -17.6288
9 N1y N 25.8720 -16.5568
10 C1y C 29.6999 -15.3159
11 C1x C 28.3540 -13.7720
12 C1x C 25.1962 -15.7995
13 O2a O 26.3557 -13.8010
14 C1x C 25.8780 -18.9572
15 C1x C 25.1962 -17.1395
16 C1b C 26.8683 -18.9572
17 O2a O 28.2200 -19.2370
18 C1z C 30.2942 -16.4111
19 O1a O 30.5564 -18.7009
20 C1b C 24.6661 -15.8576
21 C1y C 30.3465 -14.2322
22 C1y C 29.5077 -13.2825
23 C1a C 25.2021 -13.1369
24 O7a O 26.8626 -20.2914
25 C1a C 29.4905 -20.3441
26 C1x C 31.8555 -15.6946
27 O1a O 31.4476 -17.0753
28 C1a C 23.4601 -16.5510
29 O1a O 32.6072 -13.1019
30 C1y C 30.7661 -13.2768
31 C7a C 25.8313 -20.8799
32 O2a O 31.5642 -12.2047
33 C8y C 25.8255 -22.0743
34 O6a O 24.9401 -20.2798
35 C1a C 30.9640 -10.8470
36 C8y C 24.7942 -22.6569
37 C8x C 26.8450 -22.6685
38 N1y N 23.7688 -22.0567
39 C8x C 24.7825 -23.8396
40 C8x C 26.9093 -23.8570
41 C5x C 23.4251 -20.9090
42 C5x C 22.7900 -22.7268
43 C8x C 25.8080 -24.4514
44 C1x C 22.2424 -20.9616
45 O5x O 24.0133 -19.9593
46 C1y C 21.8462 -22.0101
47 O5x O 22.8309 -23.9153
48 C1a C 20.7101 -22.3539
BOND 55
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 1 5 1
5 2 6 1
6 2 7 1
7 8 3 1 #Down
8 3 9 1
9 4 10 1
10 4 11 1
11 5 12 1
12 5 13 1 #Down
13 6 14 1 #Down
14 6 15 1
15 6 16 1 #Up
16 7 17 1 #Up
17 8 18 1
18 8 19 1
19 9 20 1
20 10 21 1
21 11 22 1
22 13 23 1
23 16 24 1
24 17 25 1
25 18 26 1
26 18 27 1 #Up
27 20 28 1
28 21 29 1 #Down
29 22 30 1
30 24 31 1
31 30 32 1 #Up
32 31 33 1
33 31 34 2
34 32 35 1
35 33 36 2
36 33 37 1
37 36 38 1
38 36 39 1
39 37 40 2
40 38 41 1
41 38 42 1
42 39 43 2
43 41 44 1
44 41 45 2
45 42 46 1
46 42 47 2
47 46 48 1 #Up
48 7 8 1
49 9 14 1
50 10 18 1
51 12 15 1
52 21 22 1
53 26 30 1
54 40 43 1
55 44 46 1
| 
