ATOM 63
1 C2y C 13.8861 -19.1559
2 C1y C 14.8674 -20.2073
3 C1z C 16.1993 -20.2073
4 C1y C 17.1106 -19.0858
5 C1y C 14.2366 -17.7539
6 C1x C 16.7601 -17.6838
7 C1z C 15.4983 -17.1230
8 C1z C 16.6199 -21.5392
9 C7x C 15.5684 -22.3804
10 O7x O 14.3768 -21.5392
11 O6a O 15.5684 -23.7823
12 C1y C 13.1150 -16.9828
13 C1y C 11.9233 -17.8240
14 C2y C 12.3439 -19.1559
15 C1a C 11.5027 -20.2774
16 O7a O 10.7317 -17.1230
17 C7a C 9.5400 -17.8240
18 C2c C 8.3483 -17.1230
19 C1a C 7.1567 -17.8240
20 O6a O 9.5400 -19.2260
21 C2b C 8.3483 -15.7211
22 C1a C 9.5400 -15.0201
23 C1a C 16.6199 -22.9412
24 O1a O 17.8116 -22.2402
25 O1a O 17.3910 -20.9083
26 O7a O 13.1150 -15.5809
27 C7a C 11.9233 -14.8799
28 O6a O 10.7317 -15.5809
29 C1b C 11.9233 -13.4779
30 C1b C 10.7317 -12.7770
31 C1b C 9.5400 -13.4779
32 C1b C 8.3483 -12.7770
33 C1b C 7.1567 -13.4779
34 C1b C 5.9650 -12.7770
35 C1a C 4.7733 -13.4779
36 O7a O 15.4983 -15.7211
37 C7a C 15.4983 -14.3191
38 C1a C 16.6900 -13.6181
39 O6a O 14.3067 -13.6181
40 C1a C 16.6900 -16.4221
41 O7a O 18.3023 -19.7868
42 C7a C 19.4939 -19.0858
43 C1b C 20.6856 -19.7868
44 O6a O 19.4939 -17.6838
45 C1b C 21.8772 -19.0858
46 C1b C 23.0689 -19.7868
47 C1b C 24.2606 -19.0858
48 C1b C 24.2606 -17.6838
49 C1b C 22.9988 -17.0529
50 C1b C 22.9988 -15.6510
51 C1b C 21.8072 -14.9500
52 C1b C 21.8072 -13.5480
53 C1b C 20.5901 -12.8520
54 C1b C 20.5843 -11.4454
55 N1b N 21.8188 -10.7257
56 C5a C 23.0350 -11.4209
57 C1b C 24.2602 -10.7060
58 O5a O 23.0407 -12.8468
59 C1c C 25.4747 -11.3750
60 C6a C 26.6889 -10.6740
61 N1a N 25.4187 -12.7765
62 O6a O 26.6889 -9.2723
63 O6a O 27.8726 -11.3568
BOND 65
1 3 4 1
2 1 5 1
3 4 6 1
4 2 3 1
5 1 2 1
6 6 7 1
7 3 8 1
8 8 9 1
9 9 10 1
10 5 7 1
11 2 10 1
12 9 11 2
13 5 12 1
14 12 13 1
15 13 14 1
16 1 14 2
17 14 15 1
18 13 16 1 #Down
19 16 17 1
20 17 18 1
21 18 19 1
22 17 20 2
23 18 21 2
24 21 22 1
25 8 23 1 #Up
26 8 24 1 #Down
27 3 25 1 #Up
28 12 26 1 #Up
29 26 27 1
30 27 28 2
31 27 29 1
32 29 30 1
33 30 31 1
34 31 32 1
35 32 33 1
36 33 34 1
37 34 35 1
38 7 36 1 #Up
39 36 37 1
40 37 38 1
41 37 39 2
42 7 40 1 #Down
43 4 41 1 #Down
44 41 42 1
45 42 43 1
46 42 44 2
47 43 45 1
48 45 46 1
49 46 47 1
50 47 48 1
51 48 49 1
52 49 50 1
53 50 51 1
54 51 52 1
55 52 53 1
56 53 54 1
57 54 55 1
58 55 56 1
59 56 57 1
60 56 58 2
61 57 59 1
62 59 60 1
63 59 61 1 #Up
64 60 62 2
65 60 63 1
| 
