ATOM 44
1 C8y C 13.2326 -16.6907
2 C8x C 13.2326 -18.0960
3 C8x C 14.4272 -18.7987
4 C8y C 15.6217 -18.0960
5 C8y C 15.6217 -16.6907
6 C8y C 14.4272 -15.9880
7 N4x N 17.0271 -18.5879
8 C8y C 17.8001 -17.3933
9 C8y C 17.0271 -16.2690
10 C1z C 19.0649 -16.9717
11 C1y C 19.0649 -15.5664
12 C1x C 17.8001 -15.1447
13 C1z C 20.3298 -17.6042
14 C1z C 21.5243 -16.9717
15 C1x C 21.5243 -15.5664
16 C1x C 20.3298 -14.9339
17 C1x C 20.3298 -19.0798
18 C1x C 21.5243 -19.7825
19 C1y C 22.7189 -19.0798
20 C1z C 22.7189 -17.6042
21 O2x O 23.9135 -19.7825
22 C1y C 25.1081 -19.0798
23 C1y C 25.1081 -17.6042
24 C1y C 23.9135 -16.9717
25 C1a C 19.0652 -18.4474
26 C1a C 19.7676 -16.1285
27 O2x O 23.9135 -18.3771
28 O1a O 26.3025 -16.9015
29 O1a O 22.5081 -15.9880
30 C1x C 14.4272 -14.6529
31 C1y C 13.1623 -13.9502
32 C1y C 11.9678 -14.6529
33 C5x C 11.9678 -16.0582
34 O5x O 10.7732 -16.8312
35 C1z C 12.8813 -12.6151
36 O2x O 11.4759 -12.4745
37 C1z C 10.9137 -13.7394
38 C1a C 14.2164 -12.2637
39 C1a C 12.7407 -11.2097
40 C1a C 9.7192 -13.0367
41 C1a C 9.7192 -14.4421
42 C2c C 26.3250 -19.7825
43 C2a C 26.3250 -21.1879
44 C1a C 27.5251 -19.0894
BOND 52
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 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 13 26 1 #Up
32 20 27 1 #Down
33 24 27 1 #Down
34 23 28 1 #Down
35 14 29 1 #Down
36 6 30 1
37 30 31 1
38 32 33 1
39 1 33 1
40 32 31 1
41 33 34 2
42 31 35 1
43 35 36 1
44 36 37 1
45 32 37 1
46 35 38 1
47 35 39 1
48 37 40 1
49 37 41 1
50 42 43 2
51 42 44 1
52 22 42 1 #Up
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