ATOM 35
1 C1x C 13.4400 -20.3700
2 C1y C 13.4400 -21.7700
3 C1z C 14.6524 -22.4700
4 C1y C 15.8649 -21.7700
5 C1z C 15.8649 -20.3700
6 C1x C 14.6524 -19.6700
7 C1x C 17.0773 -22.4700
8 C1x C 18.2897 -21.7700
9 C1z C 18.2897 -20.3700
10 C1y C 17.0773 -19.6700
11 C1z C 19.5022 -19.6700
12 C2y C 19.5022 -18.2700
13 C2x C 18.2897 -17.5700
14 C5x C 17.0773 -18.2700
15 C1x C 20.7146 -20.3700
16 C1x C 21.9270 -19.6700
17 C1z C 21.9270 -18.2700
18 C1y C 20.7146 -17.5700
19 C1x C 23.1395 -17.5700
20 C1y C 23.1395 -16.1700
21 C1z C 21.9270 -15.4700
22 C1x C 20.7146 -16.1700
23 C1a C 13.9524 -23.6824
24 C1a C 15.3524 -23.6824
25 O1a O 12.2276 -22.4700
26 C1a C 15.8649 -18.9700
27 O5x O 15.8669 -17.5712
28 C1a C 19.5022 -21.0700
29 C1a C 21.9270 -17.1500
30 C1a C 22.6270 -14.2576
31 C6a C 21.2270 -14.2576
32 O6a O 19.8102 -14.2573
33 O6a O 21.9270 -13.0452
34 O1a O 24.3746 -15.4566
35 C1a C 18.2897 -19.5300
BOND 39
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 2
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 17 18 1
21 12 18 1
22 17 19 1
23 19 20 1
24 20 21 1
25 21 22 1
26 18 22 1
27 3 23 1
28 3 24 1
29 2 25 1 #Up
30 5 26 1 #Up
31 14 27 2
32 11 28 1 #Down
33 17 29 1 #Up
34 21 30 1 #Up
35 21 31 1
36 31 32 1
37 31 33 2
38 20 34 1 #Down
39 9 35 1 #Up
| 
