ATOM 60
1 C1y C 27.2156 -12.1720
2 C1x C 28.4272 -12.8715
3 C1y C 29.6390 -12.1720
4 C1y C 29.6390 -10.7729
5 O2x O 28.4272 -10.0734
6 C1x C 22.4587 -9.3039
7 C1y C 22.4587 -10.7030
8 O2x O 23.6703 -11.4025
9 C2x C 24.8821 -9.3039
10 C2x C 23.6703 -8.6044
11 C2b C 21.2472 -10.0034
12 C2b C 20.0355 -10.7030
13 C1b C 18.8239 -10.0034
14 C1b C 17.6123 -10.7030
15 C6a C 16.4006 -10.0034
16 O6a O 15.1890 -10.7030
17 O6a O 16.4006 -8.6047
18 C1z C 24.9206 -10.7329
19 O2x O 26.0271 -11.5891
20 C1z C 27.1834 -10.8016
21 C1x C 26.7916 -9.4585
22 C1x C 25.3932 -9.4160
23 O2x O 30.9695 -12.6044
24 C1y C 31.7919 -11.4725
25 C1x C 30.9695 -10.3407
26 C1c C 32.7146 -12.4977
27 C1z C 32.7146 -13.8967
28 O2x O 31.5135 -14.5905
29 C1y C 31.5138 -15.9896
30 C1y C 32.7257 -16.6889
31 C1x C 33.9267 -15.9952
32 C1y C 33.9264 -14.5961
33 C2c C 30.7779 -17.2280
34 C1b C 29.3788 -17.2218
35 C1z C 28.6738 -18.4302
36 C2a C 31.4602 -18.4330
37 O1a O 31.5337 -13.4253
38 C1a C 26.0123 -12.8857
39 C1a C 35.1309 -13.9005
40 C1a C 32.7256 -18.1180
41 O2x O 27.2858 -18.4238
42 C1y C 26.5806 -19.6321
43 C1x C 27.2746 -20.8471
44 C1y C 28.6625 -20.8535
45 C1x C 29.3678 -19.6451
46 O2x O 27.9744 -17.2187
47 C1y C 25.8811 -18.4205
48 C1y C 26.5919 -17.1897
49 C1x C 25.6410 -16.1332
50 C1z C 24.3424 -16.7113
51 O2x O 24.4909 -18.1249
52 N1x N 24.3426 -15.3199
53 C1x C 23.1310 -14.6203
54 C1y C 21.9193 -15.3196
55 C1x C 21.9191 -16.7110
56 C1y C 23.1306 -17.4106
57 C1a C 23.1303 -18.8173
58 C1a C 20.6929 -14.6112
59 C1a C 29.3655 -22.0849
60 O1a O 33.9895 -12.0090
BOND 68
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 6 7 1
6 7 8 1
7 9 10 2
8 6 10 1
9 7 11 1
10 11 12 2
11 12 13 1
12 13 14 1
13 14 15 1
14 15 16 1
15 15 17 2
16 18 19 1
17 20 19 1 #Up
18 20 21 1
19 21 22 1
20 18 22 1
21 9 18 1
22 18 8 1 #Down
23 5 20 1
24 20 1 1
25 3 23 1
26 23 24 1
27 24 25 1
28 4 25 1
29 24 26 1
30 26 27 1
31 27 28 1
32 28 29 1
33 29 30 1
34 30 31 1
35 31 32 1
36 27 32 1
37 29 33 1
38 33 34 1
39 34 35 1
40 33 36 2
41 27 37 1 #Down
42 1 38 1 #Down
43 32 39 1 #Down
44 30 40 1 #Down
45 35 41 1 #Down
46 42 41 1 #Down
47 42 43 1
48 43 44 1
49 44 45 1
50 35 45 1
51 35 46 1
52 42 47 1
53 47 48 1
54 46 48 1
55 48 49 1
56 49 50 1
57 51 50 1 #Down
58 47 51 1
59 50 52 1
60 52 53 1
61 53 54 1
62 54 55 1
63 55 56 1
64 50 56 1
65 56 57 1 #Down
66 54 58 1 #Down
67 44 59 1 #Down
68 26 60 1 #Down
| 
