ATOM 46
1 C2y C 32.8190 -23.9639
2 C2y C 31.7952 -24.5501
3 C2y C 32.8347 -22.7912
4 C5x C 33.8204 -24.5656
5 C2y C 30.7765 -23.8411
6 C5a C 31.7952 -25.7279
7 C5x C 33.8461 -22.2205
8 C1y C 31.8262 -22.1431
9 C2x C 34.8557 -23.9845
10 O5x O 33.8100 -25.7434
11 C1y C 30.8125 -22.6932
12 O5a O 32.6219 -26.5670
13 C2y C 34.8557 -22.8119
14 O5x O 33.8616 -21.0374
15 C1a C 30.7970 -21.5154
16 C2c C 28.4939 -25.7183
17 N1b N 35.8798 -22.2411
18 C5a C 35.8901 -21.0685
19 C2c C 36.9077 -20.5019
20 O5a O 34.8815 -20.4772
21 C2b C 36.9231 -19.3345
22 C2b C 35.9262 -18.7327
23 C1a C 37.9478 -21.1251
24 C1a C 27.6283 -26.5675
25 O1a O 29.7966 -24.4337
26 O1a O 31.8161 -20.9036
27 C2b C 35.9537 -17.5006
28 C1c C 34.8925 -16.8560
29 C1c C 33.8430 -17.5006
30 C1c C 32.7876 -16.8798
31 C1c C 31.7323 -17.5006
32 C1c C 30.6769 -16.8798
33 C1c C 29.6216 -17.5006
34 C1c C 28.5662 -16.8798
35 C1c C 27.4859 -17.4918
36 C1c C 27.4759 -18.7335
37 C2b C 28.5312 -19.3542
38 O1a O 29.6114 -18.7423
39 C1a C 34.8897 -15.6382
40 C1a C 30.6769 -15.6382
41 C1a C 32.7876 -15.6382
42 O1a O 31.7323 -18.7423
43 O1a O 33.8548 -18.7422
44 O1a O 26.4382 -16.8754
45 C1a C 26.3141 -19.3916
46 C1a C 28.5777 -15.4701
BOND 48
1 2 6 1
2 3 7 1
3 3 8 1
4 4 9 1
5 4 10 2
6 5 11 1
7 6 12 2
8 7 13 1
9 7 14 2
10 11 15 1
11 13 17 1
12 17 18 1
13 18 19 1
14 18 20 2
15 19 21 2
16 21 22 1
17 8 11 1
18 9 13 2
19 19 23 1
20 1 2 1
21 1 3 2
22 16 24 1
23 1 4 1
24 5 25 1
25 16 6 1
26 2 5 2
27 8 26 1
28 22 27 2
29 27 28 1
30 28 29 1
31 29 30 1
32 30 31 1
33 31 32 1
34 32 33 1
35 33 34 1
36 34 35 1
37 35 36 1
38 36 37 1
39 33 38 1 #Down
40 28 39 1 #Up
41 32 40 1 #Down
42 30 41 1 #Down
43 31 42 1 #Up
44 29 43 1 #Down
45 35 44 1 #Down
46 37 16 2
47 36 45 1 #Down
48 34 46 1 #Up
|