ATOM 39
1 C1z C 25.6732 -19.1031
2 C1y C 26.7630 -18.4794
3 C1y C 25.6615 -17.8443
4 C1z C 25.6673 -20.3678
5 C1x C 24.5832 -18.4678
6 C1z C 27.8412 -19.1205
7 C1y C 26.7104 -17.2322
8 C1y C 28.9369 -18.5027
9 N1y N 24.1228 -19.7383
10 C1z C 24.5832 -20.9913
11 C1y C 26.7514 -20.9973
12 O1a O 25.6556 -21.6208
13 C1y C 23.4877 -19.1031
14 C1x C 27.8528 -20.3736
15 C1x C 28.9312 -19.7442
16 C1y C 27.8704 -16.6145
17 O7a O 25.6906 -16.5912
18 C1y C 28.9427 -17.2556
19 C1x C 24.1521 -22.0113
20 C1a C 21.7799 -19.7383
21 C1x C 23.4877 -20.3678
22 C1a C 24.9916 -22.8918
23 O1a O 26.7397 -22.2618
24 O1a O 22.3800 -18.2054
25 C2y C 30.0267 -17.8791
26 O7a O 27.8645 -15.3614
27 C7a C 25.0612 -15.5012
28 C2a C 31.1225 -17.2439
29 C7a C 28.4765 -14.2716
30 C2c C 23.8081 -15.5012
31 O6a O 25.6849 -14.4056
32 C2c C 29.7296 -14.2716
33 O6a O 27.8471 -13.1759
34 C2b C 23.1787 -16.5912
35 C1a C 23.1670 -14.4056
36 C2b C 30.3648 -15.3555
37 C1a C 30.3590 -13.1816
38 C1a C 21.9199 -16.5912
39 C1a C 31.6178 -15.3555
BOND 44
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 1 5 1
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1
9 4 10 1
10 4 11 1
11 4 12 1 #Up
12 5 13 1
13 6 14 1
14 6 15 1
15 7 16 1
16 7 17 1 #Down
17 18 8 1 #Down
18 9 19 1
19 9 20 1
20 10 21 1
21 10 22 1 #Up
22 11 23 1 #Down
23 13 24 1 #Down
24 15 25 1
25 16 26 1 #Down
26 17 27 1
27 25 28 2
28 26 29 1
29 27 30 1
30 27 31 2
31 29 32 1
32 29 33 2
33 30 34 2
34 30 35 1
35 32 36 2
36 32 37 1
37 34 38 1
38 36 39 1
39 6 8 1 #Down
40 10 19 1 #Down
41 11 14 1
42 13 21 1
43 16 18 1
44 18 25 1
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