ATOM 47
1 C1z C 26.9618 -15.8076
2 C1y C 26.9618 -17.1555
3 C1y C 27.9247 -15.0372
4 C1y C 26.8801 -14.3371
5 C1y C 25.8122 -15.1481
6 C1z C 25.8122 -17.8150
7 C1y C 27.9713 -17.9492
8 C1y C 29.1618 -15.3232
9 C1x C 27.8137 -13.7768
10 C1z C 29.2319 -17.6398
11 N2x N 25.2579 -16.5660
12 C1x C 24.6510 -15.8076
13 O2a O 25.8122 -13.8059
14 C2x C 25.2636 -18.9703
15 C1x C 24.6510 -17.1497
16 C1b C 26.3257 -18.9703
17 O2a O 27.6795 -19.2504
18 C1z C 29.7570 -16.4202
19 C1y C 29.8096 -14.2378
20 C1y C 28.9692 -13.2865
21 O1a O 30.0196 -18.7136
22 C1a C 24.6567 -13.1407
23 O7a O 26.3199 -20.3067
24 C1a C 28.8815 -20.1491
25 C1x C 31.3210 -15.7025
26 O1a O 30.9125 -17.0854
27 O2a O 32.0737 -13.1056
28 C1y C 30.2296 -13.2808
29 C7a C 25.2869 -20.8961
30 C1a C 33.1649 -13.7301
31 O2a O 31.0291 -12.2070
32 C8y C 25.2812 -22.0924
33 O6a O 24.4641 -20.2950
34 C1a C 30.2180 -10.7774
35 C8y C 24.2482 -22.6759
36 C8x C 26.3023 -22.6876
37 N1y N 23.2212 -22.0748
38 C8x C 24.2365 -23.8605
39 C8x C 26.2966 -23.8779
40 C5x C 22.8769 -20.9252
41 C5x C 22.2408 -22.7460
42 C8x C 25.2636 -24.4733
43 C1x C 21.6923 -20.9078
44 O5x O 23.5363 -19.9040
45 C1y C 21.2955 -22.0281
46 O5x O 22.2817 -23.9363
47 C1a C 20.1576 -22.3725
BOND 54
1 1 2 1
2 1 3 1
3 1 4 1 #Down
4 1 5 1
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 10 4 1 #Down
10 4 11 1
11 5 12 1
12 5 13 1 #Down
13 6 14 1 #Down
14 6 15 1
15 6 16 1 #Up
16 7 17 1 #Up
17 8 18 1
18 8 19 1
19 9 20 1
20 10 21 1
21 13 22 1
22 16 23 1
23 17 24 1
24 18 25 1
25 18 26 1 #Up
26 19 27 1 #Down
27 20 28 1
28 23 29 1
29 27 30 1
30 28 31 1 #Up
31 29 32 1
32 29 33 2
33 31 34 1
34 32 35 2
35 32 36 1
36 35 37 1
37 35 38 1
38 36 39 2
39 37 40 1
40 37 41 1
41 38 42 2
42 40 43 1
43 40 44 2
44 41 45 1
45 41 46 2
46 45 47 1 #Up
47 7 10 1
48 10 18 1
49 11 14 2
50 12 15 1
51 19 20 1
52 25 28 1
53 39 42 1
54 43 45 1
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