ATOM 43
1 C8y C 12.6716 -16.2418
2 C8x C 12.6716 -17.6419
3 C8x C 13.8617 -18.2720
4 C8y C 15.0518 -17.6419
5 C8y C 15.0518 -16.2418
6 C8y C 13.8617 -15.5417
7 N4x N 16.3820 -18.0620
8 C8y C 17.2221 -16.9418
9 C8y C 16.3820 -15.8217
10 C1z C 18.4822 -16.5218
11 C1y C 18.4822 -15.1216
12 C1y C 17.2221 -14.7016
13 C1z C 19.7423 -17.1519
14 C1z C 20.9324 -16.5218
15 C1x C 20.9324 -15.1216
16 C1x C 19.7423 -14.4216
17 C1x C 19.7423 -18.5520
18 C1x C 20.9324 -19.2521
19 C1y C 22.1226 -18.5520
20 C1z C 22.1226 -17.1519
21 O2x O 23.3127 -19.2521
22 C1y C 24.5028 -18.5520
23 C1y C 24.5028 -17.1519
24 C1y C 23.3127 -16.5218
25 C1a C 18.4822 -17.9219
26 O1a O 22.1226 -15.8217
27 C2c C 25.7630 -19.2521
28 C1a C 19.1823 -15.6817
29 O1a O 25.7630 -16.4518
30 C2a C 25.7630 -20.8622
31 C1a C 27.0231 -18.5520
32 O2x O 23.3827 -17.8519
33 C1y C 13.8617 -14.1415
34 C1y C 12.6716 -13.4415
35 C2y C 11.4815 -14.1415
36 C1x C 11.4815 -15.5417
37 C1y C 14.5618 -12.9514
38 C1x C 13.3016 -12.2513
39 C2a C 10.2213 -13.4415
40 O2x O 17.2221 -13.3015
41 C1z C 15.8919 -12.6014
42 C1a C 16.8720 -11.5513
43 C1a C 14.9118 -11.5513
BOND 52
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 2
10 5 9 1
11 8 10 1
12 10 11 1
13 11 12 1
14 9 12 1
15 10 13 1
16 13 14 1
17 14 15 1
18 15 16 1
19 11 16 1
20 13 17 1
21 17 18 1
22 18 19 1
23 19 20 1
24 14 20 1
25 19 21 1
26 21 22 1
27 22 23 1
28 23 24 1
29 20 24 1
30 10 25 1 #Down
31 14 26 1 #Down
32 22 27 1 #Up
33 13 28 1 #Up
34 23 29 1 #Up
35 27 30 2
36 27 31 1
37 20 32 1 #Down
38 24 32 1 #Down
39 6 33 1
40 33 34 1
41 34 35 1
42 35 36 1
43 1 36 1
44 33 37 1
45 37 38 1
46 34 38 1
47 35 39 2
48 12 40 1
49 37 41 1
50 40 41 1
51 41 42 1
52 41 43 1
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