ATOM 111
1 C1b C 10.7433 -15.6920
2 C1b C 11.9577 -14.9914
3 C1c C 13.2188 -15.6920
4 C1b C 14.4798 -14.9914
5 C1b C 15.6942 -15.6920
6 C1b C 16.9552 -14.9914
7 C1c C 18.1696 -15.6920
8 C1b C 19.4306 -14.9914
9 C1b C 20.6917 -15.6920
10 C1b C 21.9061 -14.9914
11 C1c C 23.1672 -15.6920
12 C1b C 24.3815 -14.9914
13 C1b C 25.6426 -15.6920
14 C1b C 26.9037 -14.9914
15 C1c C 28.1180 -15.6920
16 C1b C 29.3791 -14.9914
17 C1b C 30.5935 -15.6920
18 C1c C 31.8546 -14.9914
19 C1b C 33.0689 -15.6920
20 C1b C 34.3300 -14.9914
21 C1b C 35.5911 -15.6920
22 C1c C 36.8054 -14.9914
23 C1b C 38.0665 -15.6920
24 C1b C 39.2809 -14.9914
25 C1b C 40.5420 -15.6920
26 C1c C 41.8030 -14.9914
27 C1b C 43.0174 -15.6920
28 C1b C 44.2784 -14.9914
29 C1b C 45.4928 -15.6920
30 C1c C 46.7538 -14.9914
31 C1b C 48.0149 -15.6920
32 C1b C 49.2293 -14.9914
33 O2a O 9.2954 -15.6920
34 C1b C 7.8475 -15.6920
35 C1c C 7.8475 -17.8405
36 O2a O 9.2954 -17.8405
37 C1c C 7.8475 -19.9890
38 O1a O 9.2954 -19.9890
39 C1b C 10.7433 -17.8405
40 C1b C 11.9577 -17.1399
41 C1c C 13.2188 -17.8405
42 C1b C 14.4798 -17.1399
43 C1b C 15.6942 -17.8405
44 C1b C 16.9552 -17.1399
45 C1c C 18.1696 -17.8405
46 C1b C 19.4306 -17.1399
47 C1b C 20.6917 -17.8405
48 C1b C 21.9061 -17.1399
49 C1c C 23.1672 -17.8405
50 C1b C 24.3815 -17.1399
51 C1b C 25.6426 -17.8405
52 C1b C 26.9037 -17.1399
53 C1c C 28.1180 -17.8405
54 C1b C 29.3791 -17.1399
55 C1b C 30.5935 -17.8405
56 C1c C 31.8546 -17.1399
57 C1b C 33.0689 -17.8405
58 C1b C 34.3300 -17.1399
59 C1b C 35.5911 -17.8405
60 C1c C 36.8054 -17.1399
61 C1b C 38.0665 -17.8405
62 C1b C 39.2809 -17.1399
63 C1b C 40.5420 -17.8405
64 C1c C 41.8030 -17.1399
65 C1b C 43.0174 -17.8405
66 C1b C 44.2784 -17.1399
67 C1b C 45.4928 -17.8405
68 C1c C 46.7538 -17.1399
69 C1b C 48.0149 -17.8405
70 C1b C 49.2293 -17.1399
71 O2a O 50.6772 -14.9914
72 O2a O 50.6772 -17.1399
73 C1b C 52.0784 -17.1399
74 C1c C 52.0784 -14.9914
75 C1b C 52.0784 -12.6561
76 C1a C 13.2188 -16.6261
77 C1a C 13.2188 -19.0549
78 C1a C 18.1696 -16.6261
79 C1a C 18.1696 -19.0549
80 C1a C 23.1672 -16.6261
81 C1a C 23.1672 -19.0549
82 C1a C 28.1180 -16.6261
83 C1a C 28.1180 -19.0549
84 C1a C 31.8546 -13.7771
85 C1a C 31.8546 -16.2058
86 C1a C 36.8054 -13.7771
87 C1a C 36.8054 -16.2058
88 C1a C 41.8030 -13.7771
89 C1a C 41.8030 -16.2058
90 C1a C 46.7538 -13.7771
91 C1a C 46.7538 -16.2058
92 O2b O 53.5730 -12.6561
93 P1b P 54.9742 -12.6561
94 O2b O 56.3754 -12.6561
95 O1c O 54.9742 -11.2549
96 O1c O 54.9742 -14.0573
97 C1b C 57.0760 -13.8705
98 C1b C 58.4772 -13.8705
99 N1a N 59.1778 -15.0848
100 C1b C 1.7756 -20.6896
101 C1c C 2.9901 -19.9890
102 C1c C 4.2044 -20.6896
103 C1c C 5.4187 -19.9890
104 C1d C 6.6332 -20.6896
105 O1a O 1.7756 -22.0907
106 O1a O 2.9901 -18.5878
107 O1a O 4.2044 -22.0907
108 O1a O 5.4187 -18.5878
109 O1a O 6.6332 -19.2884
110 C1b C 6.6332 -22.0907
111 O1a O 7.6140 -23.0716
BOND 111
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 21 22 1
22 22 23 1
23 23 24 1
24 24 25 1
25 25 26 1
26 26 27 1
27 27 28 1
28 28 29 1
29 29 30 1
30 30 31 1
31 31 32 1
32 1 33 1
33 33 34 1
34 34 35 1
35 35 36 1
36 35 37 1
37 37 38 1
38 36 39 1
39 39 40 1
40 40 41 1
41 41 42 1
42 42 43 1
43 43 44 1
44 44 45 1
45 45 46 1
46 46 47 1
47 47 48 1
48 48 49 1
49 49 50 1
50 50 51 1
51 51 52 1
52 52 53 1
53 53 54 1
54 54 55 1
55 55 56 1
56 56 57 1
57 57 58 1
58 58 59 1
59 59 60 1
60 60 61 1
61 61 62 1
62 62 63 1
63 63 64 1
64 64 65 1
65 65 66 1
66 66 67 1
67 67 68 1
68 68 69 1
69 69 70 1
70 32 71 1
71 70 72 1
72 72 73 1
73 71 74 1
74 73 74 1
75 74 75 1
76 3 76 1 #Down
77 41 77 1 #Down
78 7 78 1 #Down
79 45 79 1 #Down
80 11 80 1 #Down
81 49 81 1 #Down
82 15 82 1 #Down
83 53 83 1 #Down
84 18 84 1 #Down
85 56 85 1 #Down
86 22 86 1 #Down
87 60 87 1 #Down
88 26 88 1 #Down
89 64 89 1 #Down
90 30 90 1 #Down
91 68 91 1 #Down
92 92 93 1
93 93 94 1
94 93 95 1
95 93 96 2
96 94 97 1
97 97 98 1
98 98 99 1
99 75 92 1
100 100 101 1
101 101 102 1
102 102 103 1
103 103 104 1
104 104 37 1
105 100 105 1
106 101 106 1
107 102 107 1
108 103 108 1
109 104 109 1
110 104 110 1
111 110 111 1
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