ATOM 38
1 C1z C 28.6037 -20.4098
2 C5x C 29.8167 -19.7040
3 C2y C 27.3965 -19.7100
4 C1b C 29.3151 -21.6111
5 C1b C 27.9156 -21.6111
6 C2y C 29.8109 -18.2986
7 O5x O 31.0355 -20.3922
8 C2y C 27.3790 -18.3161
9 O1a O 26.6093 -20.4855
10 C2b C 30.7206 -21.6111
11 C2b C 26.5100 -21.6111
12 C2y C 28.5921 -17.6046
13 C5a C 31.0239 -17.6046
14 C1b C 26.1601 -17.6222
15 C2c C 31.4262 -22.8242
16 C2c C 25.8161 -22.8242
17 O1a O 28.5861 -16.1992
18 C8y C 32.2194 -18.3103
19 O5a O 31.0239 -16.1992
20 C1y C 24.6730 -18.2637
21 C1a C 32.8201 -22.8242
22 C1a C 30.7206 -24.0429
23 C1a C 24.4222 -22.8242
24 C1a C 26.5100 -24.0429
25 C8x C 32.2194 -19.7100
26 C8x C 33.4323 -17.6046
27 C1y C 23.3404 -17.8369
28 C1z C 24.6088 -19.6634
29 C8x C 33.4323 -20.4098
30 C8x C 34.6512 -18.3103
31 C1x C 22.5328 -18.9693
32 C2c C 22.6449 -16.6238
33 C1x C 23.3551 -20.0948
34 C1a C 25.5534 -19.1442
35 O1a O 24.6905 -21.0630
36 C8x C 34.6512 -19.7100
37 C1a C 23.3497 -15.4078
38 C2a C 21.2473 -16.6217
BOND 40
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1
5 2 6 1
6 2 7 2
7 3 8 2
8 3 9 1
9 4 10 1
10 5 11 1
11 6 12 2
12 6 13 1
13 8 14 1
14 10 15 2
15 11 16 2
16 12 17 1
17 13 18 1
18 13 19 2
19 14 20 1
20 15 21 1
21 15 22 1
22 16 23 1
23 16 24 1
24 18 25 2
25 18 26 1
26 20 27 1
27 20 28 1
28 25 29 1
29 26 30 2
30 27 31 1
31 27 32 1 #Down
32 28 33 1
33 28 34 1 #Down
34 28 35 1 #Up
35 29 36 2
36 32 37 1
37 32 38 2
38 8 12 1
39 30 36 1
40 31 33 1
| 
