ATOM 122
1 C1y C 25.0082 -16.0019
2 C1y C 25.0082 -17.4014
3 O2x O 26.2212 -18.1011
4 C1y C 27.4340 -17.4014
5 C1y C 27.4340 -16.0019
6 C1y C 26.2212 -15.3021
7 O7a O 28.6469 -15.3021
8 C7a C 29.8598 -16.0019
9 C8y C 31.0727 -15.3021
10 C8x C 32.2855 -16.0019
11 C8y C 33.4985 -15.3021
12 C8y C 33.4985 -13.9027
13 C8y C 32.2855 -13.2029
14 C8x C 31.0727 -13.9027
15 O7a O 34.7113 -16.0019
16 C7a C 35.9242 -15.3021
17 C8y C 37.1371 -16.0019
18 O6a O 35.9242 -13.9027
19 C8x C 37.1371 -17.4014
20 C8y C 38.3500 -18.1011
21 C8y C 39.5628 -17.4014
22 C8y C 39.5628 -16.0019
23 C8x C 38.3500 -15.3021
24 O1a O 38.3500 -19.5006
25 O1a O 40.7758 -18.1011
26 O1a O 40.7758 -15.3021
27 O1a O 34.7113 -13.2029
28 O1a O 32.2855 -11.8034
29 O6a O 29.8598 -17.4014
30 O7a O 26.2212 -13.9027
31 C7a C 27.4340 -13.2029
32 C8y C 27.4340 -11.8034
33 C8x C 28.6469 -11.1037
34 C8y C 28.6469 -9.7042
35 C8y C 27.4340 -9.0045
36 C8y C 26.2212 -9.7042
37 C8x C 26.2212 -11.1037
38 O7a O 29.8598 -9.0045
39 C7a C 29.8598 -7.6050
40 C8y C 31.0727 -6.9052
41 C8x C 32.2855 -7.6050
42 C8y C 33.4985 -6.9052
43 C8y C 33.4985 -5.5058
44 C8y C 32.2855 -4.8060
45 C8x C 31.0727 -5.5058
46 O1a O 34.7113 -4.8060
47 O1a O 32.2855 -3.4065
48 O1a O 34.7113 -7.6050
49 O6a O 28.6469 -6.9052
50 O1a O 27.4340 -7.6050
51 O1a O 25.0082 -9.0045
52 O6a O 28.6469 -13.9027
53 O7a O 23.7954 -15.3021
54 C7a C 23.7954 -13.9027
55 C8y C 22.5825 -13.2029
56 C8x C 22.5825 -11.8034
57 C8y C 21.3695 -11.1037
58 C8y C 20.1567 -11.8034
59 C8y C 20.1567 -13.2029
60 C8x C 21.3695 -13.9027
61 O6a O 25.0082 -13.2029
62 O1a O 18.9438 -13.9027
63 O1a O 18.9438 -11.1037
64 O7a O 21.3695 -9.7042
65 C7a C 20.1567 -9.0045
66 C8y C 20.1567 -7.6050
67 C8x C 21.3695 -6.9052
68 C8y C 21.3695 -5.5058
69 C8y C 20.1567 -4.8060
70 C8y C 18.9438 -5.5058
71 C8x C 18.9438 -6.9052
72 O6a O 18.9438 -9.7042
73 O1a O 20.1567 -3.4065
74 O1a O 22.5825 -4.8060
75 O1a O 17.7309 -4.8060
76 O7a O 23.7954 -18.1011
77 C7a C 22.5825 -17.4014
78 C8y C 21.3695 -18.1011
79 C8x C 20.1567 -17.4014
80 C8y C 18.9438 -18.1011
81 C8y C 18.9438 -19.5006
82 C8y C 20.1567 -20.2003
83 C8x C 21.3695 -19.5006
84 O7a O 17.7309 -17.4014
85 C7a C 16.5180 -18.1011
86 C8y C 15.3052 -17.4014
87 C8x C 15.3052 -16.0019
88 C8y C 14.0922 -15.3021
89 C8y C 12.8794 -16.0019
90 C8y C 12.8794 -17.4014
91 C8x C 14.0922 -18.1011
92 O1a O 17.7309 -20.2003
93 O1a O 20.1567 -21.5998
94 O6a O 22.5825 -16.0019
95 O6a O 16.5180 -19.5006
96 O1a O 11.6665 -15.3021
97 O1a O 14.0922 -13.9027
98 O1a O 11.6665 -18.1011
99 C1b C 28.6469 -18.1011
100 O7a O 28.6469 -19.5006
101 C7a C 27.4340 -20.2003
102 C8y C 27.4340 -21.5998
103 O6a O 26.2212 -19.5006
104 C8x C 26.2212 -22.2996
105 C8y C 26.2212 -23.6990
106 C8y C 27.4340 -24.3988
107 C8y C 28.6469 -23.6990
108 C8x C 28.6469 -22.2996
109 O7a O 25.0082 -24.3988
110 C7a C 25.0082 -25.7983
111 C8y C 23.7954 -26.4980
112 C8x C 22.5825 -25.7983
113 C8y C 21.3695 -26.4980
114 C8y C 21.3695 -27.8975
115 C8y C 22.5825 -28.5972
116 C8x C 23.7954 -27.8975
117 O1a O 20.1567 -28.5972
118 O1a O 22.5825 -29.9967
119 O1a O 20.1567 -25.7983
120 O6a O 26.2212 -26.4980
121 O1a O 27.4340 -25.7983
122 O1a O 29.8598 -24.3988
BOND 132
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 9 14 1
16 11 15 1
17 15 16 1
18 16 17 1
19 16 18 2
20 17 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 17 23 1
26 20 24 1
27 21 25 1
28 22 26 1
29 12 27 1
30 13 28 1
31 8 29 2
32 6 30 1
33 30 31 1
34 31 32 1
35 32 33 2
36 33 34 1
37 34 35 2
38 35 36 1
39 36 37 2
40 32 37 1
41 34 38 1
42 38 39 1
43 39 40 1
44 40 41 2
45 41 42 1
46 42 43 2
47 43 44 1
48 44 45 2
49 40 45 1
50 43 46 1
51 44 47 1
52 42 48 1
53 39 49 2
54 35 50 1
55 36 51 1
56 31 52 2
57 1 53 1
58 53 54 1
59 54 55 1
60 55 56 2
61 56 57 1
62 57 58 2
63 58 59 1
64 59 60 2
65 55 60 1
66 54 61 2
67 59 62 1
68 58 63 1
69 57 64 1
70 64 65 1
71 65 66 1
72 66 67 2
73 67 68 1
74 68 69 2
75 69 70 1
76 70 71 2
77 66 71 1
78 65 72 2
79 69 73 1
80 68 74 1
81 70 75 1
82 2 76 1
83 76 77 1
84 77 78 1
85 78 79 2
86 79 80 1
87 80 81 2
88 81 82 1
89 82 83 2
90 78 83 1
91 80 84 1
92 84 85 1
93 85 86 1
94 86 87 2
95 87 88 1
96 88 89 2
97 89 90 1
98 90 91 2
99 86 91 1
100 81 92 1
101 82 93 1
102 77 94 2
103 85 95 2
104 89 96 1
105 88 97 1
106 90 98 1
107 4 99 1
108 99 100 1
109 100 101 1
110 101 102 1
111 101 103 2
112 102 104 2
113 104 105 1
114 105 106 2
115 106 107 1
116 107 108 2
117 102 108 1
118 105 109 1
119 109 110 1
120 110 111 1
121 111 112 2
122 112 113 1
123 113 114 2
124 114 115 1
125 115 116 2
126 111 116 1
127 114 117 1
128 115 118 1
129 113 119 1
130 110 120 2
131 106 121 1
132 107 122 1
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