ATOM 52
1 C1z C 24.5694 -15.8813
2 C1x C 24.8962 -14.6614
3 O2x O 25.7892 -15.5485
4 C1x C 24.5694 -17.1712
5 C5x C 23.4546 -15.2393
6 C1y C 25.7017 -17.8072
7 C1y C 22.3516 -15.8813
8 O5x O 23.4546 -13.9844
9 C1y C 25.7134 -19.1146
10 C1a C 26.8047 -17.1595
11 C1y C 22.3516 -17.1712
12 C1a C 21.2426 -15.2393
13 O2a O 30.5517 -19.6983
14 C1y C 24.5870 -19.7858
15 C1y C 21.2252 -17.8072
16 O1a O 23.4489 -17.8072
17 C1y C 30.5517 -22.2255
18 C1y C 24.5927 -21.0932
19 C1a C 23.4663 -19.0154
20 C1y C 21.2076 -19.1029
21 C1a C 20.1220 -17.1595
22 C1y C 30.5517 -23.4978
23 O2x O 29.4370 -21.5893
24 O2a O 25.7017 -22.5056
25 C1y C 23.4606 -21.7468
26 O7x O 22.3282 -19.7566
27 C1a C 20.0929 -19.7332
28 C1y C 29.4370 -24.1398
29 O2b O 31.6607 -24.1398
30 C1y C 28.3340 -22.2255
31 C1y C 25.6958 -24.8752
32 C7x C 22.3166 -21.0989
33 C1a C 23.4663 -23.0191
34 C1x C 28.3340 -23.4978
35 N1c N 29.4370 -25.4180
36 P1b P 32.9272 -24.1398
37 C1a C 27.2307 -21.5893
38 C1x C 25.6958 -26.1534
39 O2x O 24.5870 -24.2390
40 O6a O 21.2135 -21.7294
41 C1a C 28.3340 -26.0541
42 C1a C 30.5460 -26.0541
43 O1c O 34.1995 -24.1398
44 O1c O 32.9272 -22.8616
45 O1c O 32.9272 -25.4180
46 C1y C 24.5870 -26.7954
47 C1y C 23.4837 -24.8752
48 C1y C 23.4837 -26.1534
49 O2a O 24.5810 -28.0735
50 C1a C 22.3924 -24.2390
51 O1a O 22.3924 -26.7954
52 C1a C 23.4837 -28.7039
BOND 55
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 1 5 1
5 4 6 1
6 5 7 1
7 5 8 2
8 6 9 1
9 6 10 1 #Down
10 7 11 1
11 7 12 1 #Up
12 9 13 1 #Down
13 9 14 1
14 11 15 1
15 11 16 1 #Up
16 17 13 1 #Up
17 14 18 1
18 14 19 1 #Down
19 15 20 1
20 15 21 1 #Down
21 17 22 1
22 17 23 1
23 18 24 1 #Down
24 18 25 1
25 20 26 1
26 20 27 1 #Down
27 22 28 1
28 22 29 1 #Down
29 23 30 1
30 31 24 1 #Up
31 25 32 1
32 25 33 1 #Up
33 28 34 1
34 28 35 1 #Up
35 29 36 1
36 30 37 1 #Up
37 31 38 1
38 31 39 1
39 32 40 2
40 35 41 1
41 35 42 1
42 36 43 1
43 36 44 1
44 36 45 2
45 38 46 1
46 39 47 1
47 46 48 1
48 46 49 1 #Down
49 47 50 1 #Down
50 48 51 1 #Up
51 49 52 1
52 2 3 1
53 26 32 1
54 30 34 1
55 47 48 1
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