ATOM 46
1 C8x C 16.1700 -19.1800
2 C8x C 16.1700 -20.5800
3 C8y C 17.3824 -21.2800
4 C8y C 18.5949 -20.5800
5 C8x C 18.5949 -19.1800
6 C8y C 17.3824 -18.4800
7 O2a O 19.8324 -21.2800
8 C8y C 21.0449 -20.5800
9 C8x C 22.2760 -21.2910
10 C8x C 23.4885 -20.5912
11 C8y C 23.4887 -19.1912
12 C8x C 22.2576 -18.4802
13 C8x C 21.0451 -19.1800
14 C1b C 24.7324 -18.4800
15 C1y C 25.9449 -19.1800
16 C8y C 25.9449 -20.5798
17 C8y C 27.1573 -21.2798
18 C1x C 28.3697 -20.5798
19 C1x C 28.3697 -19.1800
20 N1y N 27.1573 -18.4800
21 C8x C 24.7324 -21.2798
22 C8y C 24.7324 -22.6798
23 C8y C 25.9449 -23.3798
24 C8x C 27.1573 -22.6798
25 O2a O 23.5032 -23.3897
26 C1a C 22.2992 -22.6946
27 O2a O 25.9449 -24.7798
28 C1a C 27.1761 -25.4908
29 O1a O 17.3824 -22.6798
30 C1b C 17.3824 -17.0802
31 C1y C 16.1532 -16.3703
32 N1y N 16.1535 -14.9801
33 C1x C 14.9412 -14.2799
34 C1x C 13.7286 -14.9796
35 C8y C 13.7283 -16.3698
36 C8y C 14.9406 -17.0701
37 C8x C 12.5158 -17.0696
38 C8y C 12.5155 -18.4696
39 C8y C 13.7278 -19.1698
40 C8x C 14.9404 -18.4701
41 O2a O 13.7276 -20.5800
42 O2a O 11.3094 -19.1657
43 C1a C 10.1262 -18.4823
44 C1a C 12.5094 -21.2831
45 C1a C 17.3784 -14.2731
46 C1a C 27.1573 -17.0800
BOND 51
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 11 14 1
16 15 14 1 #Up
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 15 20 1
23 16 21 2
24 21 22 1
25 22 23 2
26 23 24 1
27 17 24 2
28 22 25 1
29 25 26 1
30 23 27 1
31 27 28 1
32 3 29 1
33 6 30 1
34 31 30 1 #Down
35 31 32 1
36 32 33 1
37 33 34 1
38 34 35 1
39 35 36 1
40 31 36 1
41 35 37 2
42 37 38 1
43 38 39 2
44 39 40 1
45 36 40 2
46 39 41 1
47 38 42 1
48 42 43 1
49 41 44 1
50 32 45 1
51 20 46 1
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