ATOM 55
1 N1y N 18.6532 -20.3875
2 C1y C 17.9412 -19.9750
3 C5a C 17.9437 -18.5480
4 C1b C 17.1167 -18.5500
5 C1b C 18.3542 -19.2645
6 C8y C 17.2250 -21.2125
7 C8y C 17.2250 -20.3875
8 C8y C 16.5105 -19.9750
9 C8y C 15.7961 -20.3875
10 C8x C 15.7961 -21.2125
11 C8x C 16.5105 -21.6250
12 C8y C 18.6532 -21.2125
13 C8y C 17.9392 -21.6215
14 C8x C 17.9364 -22.4444
15 C8x C 18.6476 -22.8582
16 C8y C 19.3644 -21.6264
17 C8y C 19.3581 -22.4455
18 C8x C 20.0643 -22.8606
19 C8x C 20.0770 -21.2223
20 C8y C 20.7832 -21.6374
21 C8y C 20.7814 -22.4586
22 O2x O 21.5619 -22.7141
23 C1x C 22.0459 -22.0507
24 O2x O 21.5647 -21.3853
25 O2a O 15.0816 -19.9750
26 O2a O 16.5105 -19.1500
27 C1a C 15.7083 -18.9333
28 C1a C 14.3671 -20.3875
29 C1a C 19.3680 -19.9755
30 O5a O 18.5250 -17.9583
31 C8x C 16.7000 -14.8417
32 C8x C 17.4162 -14.4292
33 C8y C 18.1282 -14.8417
34 C8y C 18.1247 -15.6667
35 C8x C 18.8374 -16.0822
36 C8x C 18.8444 -14.4322
37 C8y C 19.5571 -14.8478
38 C8y C 19.5556 -15.6752
39 O2x O 20.3421 -15.9324
40 C1x C 20.8296 -15.2639
41 O2x O 20.3445 -14.5935
42 C8y C 17.4162 -16.0792
43 C8y C 16.7000 -15.6667
44 C1y C 16.7017 -17.3196
45 N1y N 17.4170 -16.9057
46 C8y C 15.9855 -16.9071
47 C8y C 15.9861 -16.0823
48 C8x C 15.2721 -15.6693
49 C8x C 15.2709 -17.3190
50 C8y C 14.5568 -16.9061
51 C8y C 14.5558 -16.0785
52 O2x O 13.7683 -15.8238
53 C1x C 13.2829 -16.4940
54 O2x O 13.7701 -17.1629
55 C1a C 18.1319 -17.3174
BOND 65
1 3 5 1
2 8 26 1
3 2 5 1 #Down
4 26 27 1
5 1 2 1
6 25 28 1
7 2 7 1
8 1 29 1
9 12 13 2
10 3 30 2
11 13 14 1
12 14 15 2
13 31 43 1
14 42 34 1
15 33 32 1
16 32 31 2
17 15 17 1
18 16 12 1
19 6 13 1
20 33 34 2
21 34 35 1
22 35 38 2
23 37 36 2
24 36 33 1
25 4 3 1
26 12 1 1
27 16 17 2
28 17 18 1
29 18 21 2
30 37 38 1
31 38 39 1
32 39 40 1
33 40 41 1
34 41 37 1
35 20 19 2
36 19 16 1
37 6 7 2
38 7 8 1
39 42 43 2
40 43 47 1
41 46 44 1
42 44 45 1
43 45 42 1
44 8 9 2
45 9 10 1
46 10 11 2
47 20 21 1
48 46 47 2
49 47 48 1
50 48 51 2
51 50 49 2
52 49 46 1
53 21 22 1
54 22 23 1
55 23 24 1
56 24 20 1
57 11 6 1
58 50 51 1
59 51 52 1
60 52 53 1
61 53 54 1
62 54 50 1
63 9 25 1
64 45 55 1
65 44 4 1 #Up
| 
