ATOM 38
1 C1y C 20.8014 -15.4814
2 N1y N 20.8014 -16.8186
3 C2y C 22.0682 -17.5224
4 C2x C 23.2646 -16.8186
5 C1x C 23.2646 -15.4814
6 S2x S 22.0682 -14.7777
7 C1y C 19.3939 -15.4814
8 C5x C 19.3939 -16.8186
9 N1b N 18.1975 -14.7777
10 C5a C 17.0011 -15.4814
11 O5a O 17.0011 -16.8186
12 O5x O 18.1975 -17.5224
13 C2c C 15.8047 -14.7777
14 C8y C 14.5379 -15.4814
15 C8x C 13.4119 -14.6369
16 S2x S 12.2859 -15.4814
17 C8y C 12.7081 -16.8186
18 N5x N 14.1157 -16.8186
19 N2b N 15.8047 -13.2998
20 C7a C 22.0682 -19.0003
21 O7a O 23.2646 -19.7040
22 O6a O 20.8014 -19.7040
23 O2a O 17.0011 -12.6664
24 C1a C 17.0011 -11.2588
25 C1b C 24.4610 -19.0003
26 O7a O 25.6574 -19.7040
27 C7a C 26.8538 -19.0003
28 C1d C 28.0502 -19.7040
29 O6a O 26.8538 -17.5927
30 C1a C 29.3170 -19.0003
31 C1a C 28.0502 -21.2516
32 C1a C 29.2466 -20.4078
33 C5a C 10.3153 -16.8186
34 N1b N 11.5117 -17.5224
35 C1c C 9.1189 -17.5224
36 O5a O 10.3153 -15.4111
37 C1a C 7.9225 -16.8186
38 N1a N 9.1189 -18.9299
BOND 40
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 1
8 7 8 1
9 2 8 1
10 7 9 1 #Up
11 9 10 1
12 10 11 2
13 8 12 2
14 10 13 1
15 13 14 1
16 14 15 2
17 15 16 1
18 16 17 1
19 17 18 2
20 14 18 1
21 13 19 2
22 3 20 1
23 20 21 1
24 20 22 2
25 19 23 1
26 23 24 1
27 21 25 1
28 25 26 1
29 26 27 1
30 27 28 1
31 27 29 2
32 28 30 1
33 28 31 1
34 28 32 1
35 33 34 1
36 34 17 1
37 33 35 1
38 33 36 2
39 35 37 1
40 35 38 1 #Up
|