ATOM 40
1 C1y C 23.7241 -20.7903
2 C1y C 23.7241 -22.1704
3 C1y C 24.9661 -22.8603
4 C1y C 26.1391 -22.1704
5 O2x O 26.1391 -20.7903
6 C1y C 24.9661 -20.1004
7 O2a O 24.9661 -18.7204
8 N1b N 22.5511 -20.1004
9 O1a O 24.9661 -24.2403
10 C1b C 27.6564 -22.8603
11 O1a O 22.5511 -22.8603
12 C1y C 27.3804 -16.5814
13 C1y C 27.3804 -17.9614
14 C1y C 28.6224 -18.6514
15 C1y C 29.7954 -17.9614
16 C1y C 29.7954 -16.5814
17 C1y C 28.6224 -15.8914
18 O1a O 30.9684 -15.8914
19 O2a O 25.8632 -15.8914
20 O1a O 28.6224 -20.0314
21 N1b N 28.6224 -14.5114
22 O1a O 26.2075 -18.6514
23 N1b N 30.9684 -18.6514
24 C1y C 24.1381 -17.6165
25 C1y C 24.5521 -16.3054
26 O2x O 23.4482 -15.4774
27 C1y C 22.3440 -16.3054
28 C1z C 22.7581 -17.6165
29 C1a C 21.0331 -15.8914
30 C1b C 21.9302 -18.7204
31 C2c C 29.7954 -13.8214
32 N2a N 29.7954 -12.4415
33 N1a N 30.9684 -14.5114
34 C1a C 21.3781 -20.7903
35 O1a O 28.8984 -22.1704
36 C2c C 30.9684 -20.3757
37 N1a N 29.7954 -21.0658
38 N2a N 32.1413 -21.0658
39 O1a O 20.5501 -18.5825
40 O1a O 22.7581 -18.9963
BOND 42
1 1 2 1
2 13 22 1 #Up
3 4 10 1 #Up
4 15 23 1 #Up
5 2 3 1
6 2 11 1 #Up
7 3 4 1
8 4 5 1
9 5 6 1
10 24 25 1
11 25 26 1
12 26 27 1
13 27 28 1
14 28 24 1
15 24 7 1 #Down
16 6 1 1
17 27 29 1 #Down
18 28 30 1 #Up
19 25 19 1 #Up
20 6 7 1 #Down
21 21 31 1
22 12 13 1
23 31 32 2
24 13 14 1
25 31 33 1
26 14 15 1
27 8 34 1
28 15 16 1
29 10 35 1
30 16 17 1
31 23 36 1
32 17 12 1
33 36 37 1
34 36 38 2
35 16 18 1 #Down
36 30 39 1
37 1 8 1 #Down
38 28 40 1
39 12 19 1 #Down
40 14 20 1 #Down
41 3 9 1 #Down
42 17 21 1 #Up
|