ATOM 133
1 C1y C 39.1280 -15.0792
2 O2x O 40.3450 -15.7455
3 C1y C 41.5412 -15.0182
4 C1y C 41.5095 -13.6186
5 C1y C 40.2924 -12.9523
6 C1y C 39.0962 -13.6796
7 C1y C 29.5400 -18.9000
8 C8y C 37.9400 -18.2700
9 C8y C 36.7500 -18.9700
10 C8y C 39.1300 -18.9000
11 C8x C 36.7500 -20.3700
12 O2x O 35.5600 -18.2700
13 C8x C 39.1300 -20.3000
14 O2x O 40.3900 -18.2000
15 C8y C 38.0100 -21.0000
16 C8y C 34.3700 -18.9700
17 C8y C 41.5800 -18.9000
18 C1y C 38.0100 -23.1700
19 C8y C 34.3700 -20.3700
20 C8x C 33.1100 -18.2700
21 C8y C 42.7700 -18.2000
22 C8x C 41.5800 -20.2300
23 C5x C 36.8900 -23.8700
24 N1x N 39.2700 -23.8000
25 C8x C 33.1800 -21.0700
26 X Cl 35.5600 -21.0700
27 C8x C 31.9900 -18.9700
28 C8x C 43.9600 -18.8300
29 X Cl 42.7700 -16.8000
30 C8x C 42.8400 -20.9300
31 N1x N 35.6300 -23.1700
32 O5x O 36.8900 -25.2700
33 C5x C 40.4600 -23.1000
34 C8y C 31.9900 -20.3700
35 C8y C 43.9600 -20.2300
36 C1y C 34.5100 -23.8700
37 C1y C 41.6500 -23.7300
38 O5x O 40.4600 -21.7000
39 C1y C 30.8000 -21.1400
40 C1x C 45.2200 -20.9300
41 C8y C 34.5100 -25.2700
42 C5x C 33.2500 -23.1700
43 N1x N 42.8400 -23.0300
44 C1y C 30.8000 -23.1700
45 O2a O 29.5400 -20.4400
46 C1y C 45.2200 -23.0300
47 C8x C 33.2500 -25.9700
48 C8x C 35.7000 -25.9700
49 N1x N 32.0600 -23.8700
50 C5x C 44.0300 -23.7300
51 C5x C 29.6100 -23.9400
52 C8y C 33.2500 -27.3700
53 C8x C 35.7000 -27.3700
54 O5x O 44.0300 -25.1300
55 N1x N 29.6100 -25.2700
56 O5x O 28.3500 -23.2400
57 C8y C 32.0600 -28.0700
58 C8y C 34.5100 -28.0700
59 C1y C 30.8700 -25.9700
60 C8y C 30.8700 -27.3700
61 C8y C 32.0600 -29.4700
62 O1a O 34.5100 -29.4700
63 C6a C 28.5600 -27.3700
64 C8x C 29.7500 -28.0700
65 C8x C 30.9400 -30.1700
66 O2a O 33.3200 -30.1700
67 O6a O 27.1600 -27.3700
68 O6a O 28.5600 -28.7700
69 C8y C 29.7500 -29.4700
70 O1a O 28.4900 -30.2400
71 C1y C 33.3200 -31.5700
72 C8y C 41.6500 -25.1300
73 C8x C 40.4600 -25.8300
74 C8y C 40.4600 -27.2300
75 C8x C 41.6500 -27.9300
76 C8y C 42.8400 -27.2300
77 C8x C 42.8400 -25.8300
78 O1a O 39.2700 -27.9300
79 O5x O 33.2500 -21.7700
80 O2x O 44.0553 -27.9251
81 C8y C 44.0611 -29.3297
82 C8y C 42.8285 -30.0486
83 C8x C 42.8346 -31.4485
84 C8x C 44.0501 -32.1432
85 C8y C 45.2828 -31.4243
86 C8x C 45.2766 -30.0243
87 O1a O 41.6138 -29.3544
88 C1y C 46.5062 -32.1235
89 C5x C 47.6931 -31.4311
90 O5x O 48.8907 -32.1156
91 N1x N 47.6953 -23.7251
92 N1a N 46.5125 -33.5296
93 O2a O 37.9086 -15.8204
94 C1b C 42.7579 -15.6847
95 N1b N 37.8825 -13.0146
96 O1a O 43.9652 -14.9510
97 O1a O 40.2606 -11.5513
98 O1a O 42.6921 -12.8999
99 O2x O 30.7524 -18.2000
100 C1y C 30.7524 -16.8000
101 C1y C 29.5400 -16.1000
102 C1y C 28.3276 -16.8000
103 C1y C 28.3276 -18.2000
104 C1b C 31.9479 -16.1096
105 O1a O 27.1321 -16.1096
106 O1a O 29.5400 -14.7000
107 N1b N 27.1321 -18.8904
108 C5a C 27.1320 -20.2997
109 C1a C 25.9406 -20.9878
110 O5a O 28.3654 -21.0121
111 O1a O 33.1353 -16.7951
112 C1y C 32.1076 -32.2700
113 C1y C 32.1076 -33.6700
114 C1y C 33.3200 -34.3700
115 C1y C 34.5324 -33.6700
116 O2x O 34.5324 -32.2700
117 O1a O 33.3200 -35.7700
118 O1a O 30.9121 -31.5796
119 C1b C 35.7279 -34.3604
120 O1a O 30.9121 -34.3604
121 O1a O 36.9153 -33.6749
122 C5a C 37.8513 -11.6201
123 C1b C 36.6379 -10.9552
124 O5a O 39.0614 -10.8848
125 C1b C 35.4054 -11.7034
126 C1b C 34.1836 -11.0333
127 C1b C 32.9576 -11.7771
128 C1b C 31.7327 -11.1049
129 C1b C 30.5079 -11.8477
130 C1c C 29.2827 -11.1750
131 C1b C 28.0578 -11.9175
132 C1a C 26.8328 -11.2447
133 C1a C 29.2528 -9.8000
BOND 146
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 18 23 1
8 18 24 1 #Up
9 19 25 2
10 19 26 1
11 20 27 1
12 21 28 2
13 21 29 1
14 22 30 1
15 23 31 1
16 23 32 2
17 24 33 1
18 25 34 1
19 28 35 1
20 36 31 1 #Down
21 33 37 1
22 33 38 2
23 34 39 1
24 35 40 1
25 36 41 1
26 36 42 1
27 37 43 1 #Up
28 39 44 1
29 39 45 1 #Down
30 40 46 1
31 41 47 1
32 41 48 2
33 42 49 1
34 43 50 1
35 44 51 1
36 47 52 2
37 48 53 1
38 50 54 2
39 51 55 1
40 51 56 2
41 52 57 1
42 52 58 1
43 59 55 1
44 57 60 2
45 57 61 1
46 58 62 1
47 59 63 1 #Down
48 60 64 1
49 61 65 2
50 61 66 1
51 63 67 1
52 63 68 2
53 64 69 2
54 69 70 1
55 13 15 2
56 27 34 2
57 30 35 2
58 44 49 1 #Down
59 46 50 1
60 53 58 2
61 59 60 1
62 65 69 1
63 71 66 1 #Up
64 8 9 1
65 8 10 2
66 37 72 1
67 9 11 2
68 9 12 1
69 10 13 1
70 10 14 1
71 72 73 2
72 73 74 1
73 74 75 2
74 75 76 1
75 76 77 2
76 77 72 1
77 11 15 1
78 74 78 1
79 12 16 1
80 14 17 1
81 15 18 1
82 16 19 1
83 16 20 2
84 17 21 1
85 17 22 2
86 42 79 2
87 7 45 1 #Up
88 76 80 1
89 80 81 1
90 81 82 2
91 82 83 1
92 83 84 2
93 84 85 1
94 85 86 2
95 81 86 1
96 82 87 1
97 85 88 1
98 88 89 1
99 89 90 2
100 46 91 1 #Up
101 88 92 1 #Down
102 91 89 1
103 8 93 1
104 1 93 1 #Up
105 3 94 1 #Up
106 6 95 1 #Down
107 94 96 1
108 5 97 1 #Up
109 4 98 1 #Down
110 7 99 1
111 99 100 1
112 100 101 1
113 101 102 1
114 102 103 1
115 7 103 1
116 100 104 1 #Up
117 102 105 1 #Up
118 101 106 1 #Down
119 103 107 1 #Down
120 107 108 1
121 108 109 1
122 108 110 2
123 104 111 1
124 71 112 1
125 112 113 1
126 113 114 1
127 114 115 1
128 115 116 1
129 71 116 1
130 114 117 1 #Up
131 112 118 1 #Down
132 115 119 1 #Down
133 113 120 1 #Down
134 119 121 1
135 95 122 1
136 122 123 1
137 122 124 2
138 123 125 1
139 125 126 1
140 126 127 1
141 127 128 1
142 128 129 1
143 129 130 1
144 130 131 1
145 131 132 1
146 130 133 1
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