ATOM 236
1 Z Na 33.7294 -21.5712 #+
2 C1y C 21.8127 -25.3330
3 C1x C 23.1905 -25.0376
4 C1y C 24.2784 -27.3297
5 C1y C 21.1867 -26.6102
6 O2x O 23.1708 -28.2113
7 C1y C 21.7938 -27.8867
8 C1c C 19.1439 -14.2065
9 C1c C 17.8962 -14.7933
10 C1b C 16.7644 -14.0065
11 C1c C 15.5168 -14.5932
12 C1c C 14.3850 -13.8063
13 C1b C 13.1374 -14.3930
14 C2b C 12.0055 -13.6062
15 C2a C 10.7581 -14.1929
16 O1a O 17.7808 -16.1669
17 C1a C 15.4014 -15.9668
18 C1a C 14.5004 -12.4328
19 O1a O 19.2593 -12.8329
20 O2x O 31.1464 -14.8700
21 C1y C 32.5201 -14.9855
22 C1y C 33.4008 -16.0280
23 C1x C 33.2853 -17.4018
24 C2x C 32.2428 -18.2826
25 C2x C 30.8691 -18.1670
26 C1y C 29.9882 -17.1246
27 C1y C 30.1038 -15.7508
28 C1y C 20.5561 -14.9479
29 C1x C 20.4407 -16.3216
30 C1x C 21.5506 -17.1068
31 C1z C 22.8448 -16.5238
32 C1y C 22.9602 -15.1501
33 O2x O 21.7817 -14.3592
34 O2x O 23.9547 -17.3089
35 C1z C 25.1801 -16.7202
36 C1y C 25.2957 -15.3464
37 C1x C 24.1859 -14.5614
38 C1x C 26.3588 -17.5111
39 C1z C 27.5843 -16.9223
40 C1y C 27.6998 -15.5486
41 O2x O 26.5899 -14.7636
42 O2x O 28.6942 -17.7075
43 C1x C 28.9253 -14.9600
44 O2x O 34.7348 -15.7944
45 C1y C 35.1880 -14.5182
46 C1z C 34.3073 -13.4757
47 C1x C 32.9734 -13.7095
48 C1x C 36.5963 -14.2216
49 C1y C 37.0496 -12.9455
50 C1z C 36.1689 -11.9029
51 O2x O 34.8349 -12.1366
52 C1x C 36.1354 -10.6551
53 C1x C 37.3096 -9.8544
54 C1z C 38.5858 -10.3076
55 C1y C 39.0999 -11.5961
56 O2x O 38.3778 -12.7803
57 C1x C 40.4644 -11.7937
58 C1z C 41.3176 -10.7110
59 C1y C 40.8035 -9.4226
60 O2x O 39.4391 -9.2249
61 O2x O 42.6821 -10.9085
62 C1z C 43.5353 -9.8258
63 C1y C 43.0211 -8.5373
64 C1x C 41.6568 -8.3399
65 C1y C 58.8019 -20.7929
66 C1y C 58.0110 -21.9716
67 C1x C 58.1389 -19.6304
68 C1z C 56.7650 -19.5149
69 C1y C 56.0428 -20.6992
70 O2x O 56.6315 -21.9248
71 O2x O 56.1077 -18.2836
72 C1y C 54.7281 -18.2367
73 C1z C 54.0059 -19.4212
74 C1y C 54.6633 -20.6524
75 C1x C 54.1395 -17.0113
76 C1z C 52.7599 -16.9645
77 C1y C 52.0378 -18.1488
78 O2x O 52.6264 -19.3744
79 C1y C 61.0131 -24.2822
80 C1y C 60.2967 -25.3980
81 O2x O 60.8853 -26.6234
82 C1y C 62.2591 -26.7389
83 C1y C 63.0500 -25.5604
84 C1y C 62.3926 -24.3291
85 O2x O 60.3558 -23.0510
86 C1y C 58.9761 -23.0042
87 C1y C 58.2598 -24.1200
88 C1x C 58.9171 -25.3511
89 O1a O 64.4295 -25.6072
90 C1z C 49.7954 -16.0234
91 C1y C 50.9695 -15.2229
92 O2x O 52.2457 -15.6761
93 C1x C 49.6799 -17.3972
94 C1x C 50.7096 -18.3138
95 C1x C 50.8664 -13.8482
96 C1z C 49.6243 -13.2499
97 C1y C 48.4504 -14.0504
98 O2x O 48.5533 -15.4252
99 C1x C 49.5213 -11.8751
100 C1y C 48.2792 -11.2769
101 C1y C 47.1052 -12.0776
102 O2x O 47.2083 -13.4525
103 O2x O 48.1763 -9.9023
104 C1x C 46.9341 -9.3044
105 C1y C 45.7600 -10.1048
106 C1x C 45.8631 -11.4796
107 C1a C 22.7292 -17.8976
108 C1a C 25.0646 -18.2352
109 C1a C 27.4687 -18.2961
110 O1a O 63.1796 -23.1971
111 O1a O 57.4729 -25.2518
112 C1a C 41.9045 -11.9585
113 C1a C 44.1223 -11.0732
114 C1a C 33.4176 -12.4227
115 C1a C 35.2792 -10.8498
116 C1a C 38.3419 -8.9508
117 O1a O 43.4882 -7.2404
118 C1a C 50.8719 -12.6631
119 C1a C 53.5469 -15.8326
120 C1a C 57.5520 -18.3829
121 O1a O 59.5889 -19.6610
122 C1a C 53.2191 -20.5531
123 C1a C 48.7423 -16.9130
124 C1z C 24.2860 -25.8448
125 C1x C 25.4579 -27.9128
126 C1y C 26.6985 -27.2235
127 C1y C 26.6985 -25.8448
128 O2x O 25.4579 -25.1555
129 O2x O 27.8704 -27.9128
130 C1y C 29.0421 -27.2235
131 C1z C 29.0421 -25.8448
132 C1x C 27.8704 -25.1555
133 C1y C 30.2829 -27.9128
134 C1y C 31.4548 -27.2235
135 C1y C 31.4548 -25.8448
136 O2x O 30.2829 -25.1555
137 O2x O 32.6266 -27.9128
138 C1y C 33.8674 -27.2235
139 C1y C 33.8674 -25.8448
140 C1x C 32.6266 -25.1555
141 C1c C 35.0391 -27.9128
142 C1c C 36.2109 -27.2235
143 C1b C 37.4517 -27.9128
144 C1y C 38.6235 -27.2235
145 C1y C 38.6235 -25.8448
146 O2x O 39.7953 -27.9128
147 C1y C 40.9671 -27.2235
148 C1y C 40.9671 -25.8448
149 C1y C 39.7953 -25.1555
150 O2a O 37.6585 -24.4662
151 O1a O 35.0391 -25.1555
152 O1a O 36.2109 -26.0568
153 S4a S 36.6245 -23.0186
154 O1d O 37.6585 -22.0536
155 O1d O 35.5905 -23.9836
156 O1d O 35.6594 -22.0536 #-
157 C1x C 42.2078 -27.9128
158 C1y C 43.3798 -27.2235
159 C1y C 43.3798 -25.8448
160 O2x O 42.2078 -25.1555
161 O2x O 44.5515 -27.9128
162 C1y C 45.7922 -27.2235
163 C1y C 45.7922 -25.8448
164 C1x C 44.5515 -25.1555
165 C1y C 46.9641 -27.9128
166 C1y C 48.1359 -27.2235
167 C1y C 48.1359 -25.8448
168 O2x O 46.9641 -25.1555
169 O2x O 49.3767 -27.9128
170 C1y C 50.5485 -27.2235
171 C1y C 50.5485 -25.8448
172 C1y C 49.3767 -25.1555
173 C1y C 51.9959 -27.2235
174 C1y C 51.9959 -28.6020
175 C1y C 53.1678 -29.2914
176 C1y C 54.4086 -28.6020
177 C1y C 54.4086 -27.2235
178 O2x O 53.1678 -26.5342
179 O2x O 55.5804 -29.2914
180 C1y C 56.7522 -28.6020
181 C1y C 56.7522 -27.2235
182 C1x C 55.5804 -26.5342
183 C1c C 57.9241 -29.2914
184 C1b C 59.1648 -28.6020
185 C1c C 60.3365 -29.2914
186 C1b C 61.6497 -28.5141
187 O1a O 57.9241 -30.6700
188 O1a O 57.7827 -26.3222
189 O1a O 30.2829 -29.4327
190 O1a O 35.0391 -29.2914
191 C1a C 29.0421 -23.9716
192 O1a O 51.5232 -24.8700
193 O1a O 46.9641 -29.5032
194 O1a O 39.7953 -23.6370
195 O1a O 49.3767 -23.7770
196 O1a O 53.1678 -30.6700
197 O1a O 60.2676 -30.6700
198 C1a C 24.2860 -24.0784
199 O2x O 19.7780 -26.4977
200 C1y C 18.9762 -27.6613
201 C1y C 19.5833 -28.9378
202 C1y C 20.9920 -29.0504
203 C1c C 17.7214 -26.9550
204 C1b C 16.4975 -27.6615
205 C1c C 15.2737 -26.9550
206 C1c C 14.0499 -27.6615
207 C1b C 12.8260 -26.9550
208 C1c C 11.6021 -27.6615
209 C1c C 10.3783 -26.9550
210 C1c C 9.1545 -27.6615
211 C1b C 7.9306 -26.9550
212 C1c C 6.7067 -27.6615
213 C2c C 5.4830 -26.9550
214 C2c C 4.2342 -27.6762
215 C1a C 3.0144 -26.9725
216 C1a C 17.7136 -25.1181
217 C1a C 15.2737 -25.5418
218 O1a O 10.3783 -25.5419
219 O1a O 6.7067 -29.0746
220 C2a C 5.4828 -25.5422
221 C2b C 4.2347 -29.0746
222 C1b C 3.0108 -29.7813
223 O1a O 3.0108 -31.1944
224 C1a C 9.1545 -29.0744
225 O2a O 11.6021 -29.0747
226 O1a O 14.0499 -29.0746
227 O1a O 20.9527 -24.2318
228 O1a O 18.7829 -30.0996
229 O1a O 21.6089 -30.3473
230 O1a O 53.9201 -21.8459
231 S4a S 11.5934 -30.4376
232 O1d O 11.5934 -31.8508 #-
233 O1d O 13.0067 -30.4376
234 O1d O 10.1803 -30.4376
235 O1a O 51.2959 -29.8145
236 Z Na 14.3525 -33.9502 #+
BOND 265
1 2 5 1
2 5 7 1
3 2 3 1
4 6 7 1
5 8 9 1
6 9 10 1
7 10 11 1
8 11 12 1
9 12 13 1
10 13 14 1
11 14 15 2
12 9 16 1 #Down
13 11 17 1 #Up
14 12 18 1 #Down
15 8 19 1 #Down
16 20 21 1
17 21 22 1
18 22 23 1
19 23 24 1
20 24 25 2
21 25 26 1
22 26 27 1
23 27 20 1
24 28 29 1
25 29 30 1
26 30 31 1
27 31 32 1
28 32 33 1
29 28 33 1
30 31 34 1
31 34 35 1
32 35 36 1
33 36 37 1
34 32 37 1
35 35 38 1
36 38 39 1
37 39 40 1
38 40 41 1
39 36 41 1
40 39 42 1
41 42 26 1
42 27 43 1
43 40 43 1
44 22 44 1
45 44 45 1
46 45 46 1
47 46 47 1
48 21 47 1
49 45 48 1
50 48 49 1
51 49 50 1
52 50 51 1
53 46 51 1
54 54 55 1
55 52 50 1
56 55 56 1
57 53 54 1
58 52 53 1
59 56 49 1
60 55 57 1
61 57 58 1
62 58 59 1
63 59 60 1
64 54 60 1
65 58 61 1
66 61 62 1
67 62 63 1
68 63 64 1
69 59 64 1
70 65 66 1
71 65 67 1
72 67 68 1
73 68 69 1
74 69 70 1
75 66 70 1
76 68 71 1
77 71 72 1
78 72 73 1
79 73 74 1
80 69 74 1
81 72 75 1
82 75 76 1
83 76 77 1
84 77 78 1
85 73 78 1
86 79 80 1
87 80 81 1
88 81 82 1
89 82 83 1
90 83 84 1
91 79 84 1
92 79 85 1
93 85 86 1
94 86 87 1
95 87 88 1
96 80 88 1
97 86 66 1
98 83 89 1 #Up
99 92 76 1
100 90 93 1
101 91 92 1
102 93 94 1
103 90 91 1
104 77 94 1
105 91 95 1
106 95 96 1
107 96 97 1
108 97 98 1
109 90 98 1
110 96 99 1
111 99 100 1
112 100 101 1
113 101 102 1
114 97 102 1
115 100 103 1
116 103 104 1
117 104 105 1
118 105 106 1
119 101 106 1
120 62 105 1
121 31 107 1 #Up
122 35 108 1 #Up
123 39 109 1 #Up
124 8 28 1
125 84 110 1 #Down
126 87 111 1 #Up
127 58 112 1 #Up
128 62 113 1 #Up
129 46 114 1 #Down
130 50 115 1 #Down
131 54 116 1 #Down
132 63 117 1 #Up
133 96 118 1 #Down
134 76 119 1 #Down
135 68 120 1 #Down
136 65 121 1 #Up
137 73 122 1 #Up
138 90 123 1 #Up
139 125 126 1
140 126 127 1
141 127 128 1
142 124 128 1
143 126 129 1
144 129 130 1
145 130 131 1
146 131 132 1
147 127 132 1
148 130 133 1
149 133 134 1
150 134 135 1
151 135 136 1
152 131 136 1
153 134 137 1
154 137 138 1
155 138 139 1
156 139 140 1
157 135 140 1
158 138 141 1
159 141 142 1
160 142 143 1
161 143 144 1
162 144 145 1
163 144 146 1
164 146 147 1
165 147 148 1
166 148 149 1
167 145 149 1
168 145 150 1 #Down
169 139 151 1 #Up
170 142 152 1 #Up
171 150 153 1
172 153 154 2
173 153 155 2
174 153 156 1
175 147 157 1
176 157 158 1
177 158 159 1
178 159 160 1
179 148 160 1
180 158 161 1
181 161 162 1
182 162 163 1
183 163 164 1
184 159 164 1
185 162 165 1
186 165 166 1
187 166 167 1
188 167 168 1
189 163 168 1
190 166 169 1
191 169 170 1
192 170 171 1
193 171 172 1
194 167 172 1
195 173 174 1
196 174 175 1
197 175 176 1
198 176 177 1
199 177 178 1
200 173 178 1
201 170 173 1
202 176 179 1
203 179 180 1
204 180 181 1
205 181 182 1
206 177 182 1
207 180 183 1
208 183 184 1
209 184 185 1
210 185 186 1
211 183 187 1 #Up
212 181 188 1 #Up
213 133 189 1 #Down
214 141 190 1 #Up
215 131 191 1 #Up
216 171 192 1 #Up
217 165 193 1 #Down
218 149 194 1 #Down
219 172 195 1 #Down
220 175 196 1 #Down
221 185 197 1 #Down
222 82 186 1
223 3 124 1
224 124 4 1
225 4 125 1
226 4 6 1
227 124 198 1 #Up
228 5 199 1
229 199 200 1
230 200 201 1
231 201 202 1
232 7 202 1
233 200 203 1
234 203 204 1
235 204 205 1
236 205 206 1
237 206 207 1
238 207 208 1
239 208 209 1
240 209 210 1
241 210 211 1
242 211 212 1
243 212 213 1
244 213 214 1
245 214 215 1
246 203 216 1 #Up
247 205 217 1 #Up
248 209 218 1 #Up
249 212 219 1 #Up
250 213 220 2
251 214 221 2
252 221 222 1
253 222 223 1
254 210 224 1 #Down
255 208 225 1 #Down
256 206 226 1 #Down
257 2 227 1 #Down
258 201 228 1 #Up
259 202 229 1 #Up
260 74 230 1 #Down
261 231 232 1
262 231 233 2
263 231 234 2
264 225 231 1
265 174 235 1 #Up
| 
