[DFTB-Plus-User] Regarding PDOS Calculations
Bhatt, Mahesh
M.D.Bhatt at warwick.ac.uk
Fri May 10 17:48:24 CEST 2013
Dear Jan,
Thank you for your reply. I already used all schemes you suggested. I got very slight variation in PDOS of pentacene and C60, when I used gaussian broadening width 0.2 eV as shown below:
[X]
In one reference paper, the authors found the clear variation in LDOS of CuPc and C60 using GGA-PBE with VASP as:
[X]
I want to get such clear variation in PDOS of pentacene and C60. Please let me know if you have any idea about such result, I mean how can we get such result using DFTB+.
Reagrds
Mahesh
________________________________
From: dftb-plus-user-bounces at dftb-plus.info [dftb-plus-user-bounces at dftb-plus.info] on behalf of Jan M. Knaup [Jan.Knaup at bccms.uni-bremen.de]
Sent: Friday, May 10, 2013 11:07 AM
To: User list for DFTB+ related questions
Subject: Re: [DFTB-Plus-User] Regarding PDOS Calculations
Dear Mahesh,
your input structure contains 6 C60 molecures and 18 pentacenes. So, since your input geometry contains C and H atoms, you also have to specify angular momentum and SK files for both elements.
To analyze different parts of your input geometry at the same time, you can specify as many region blocks in the ProjectStates section as you need. In that case I would strongly recommend using easily distinguishable labels for the different regions.
In your input file you specify two regions, one region containing all atoms in the C60 molecules and one region containing every C atom in the geometry, i.e. all carbons in C60 and all carbons in pentacene. Are you sure that your PDOS does not vary at all between region1 and region2 ?
Maybe it helps to clarify that the regions you specify in the ProjectStates section are completely independent of each other.
Best,
Jan
Jan M. Knaup | Fon +49-(0)421-218-62351
Dipl. Phys. Dr. rer. nat. | Fax +49-(0)421-218-62770
Universität Bremen - BCCMS |
Am Fallturm 1 | Jan.Knaup at bccms.uni-bremen.de<mailto:Jan.Knaup at bccms.uni-bremen.de>
28359 Bremen | JanKnaup at gmail.com<mailto:JanKnaup at gmail.com>
Germany | www.bccms.uni-bremen.de<http://www.bccms.uni-bremen.de/>
2013/5/8 Bhatt, Mahesh <M.D.Bhatt at warwick.ac.uk<mailto:M.D.Bhatt at warwick.ac.uk>>
Hi all,
I tried to calculate the DOS projected on pentacene and C60; but I am confused with some input parameters:
My input is as follows:
Geometry = GenFormat {
1224 S
C H
1 1 -3.2502666 -1.70540032 -2.49477122
2 1 -3.50216983 -2.31774597 -1.24200601
3 1 -4.16890684 -3.60370254 -1.20569683
4 1 -4.55355447 -4.21702292 -2.42381109
5 1 -3.11810702 -1.70343484 -0.03440192
6 1 -4.42096085 -4.21700572 0.03664543
7 1 -3.36902815 -2.31761922 1.20782306
8 1 -4.03553421 -3.60334803 1.24418026
9 1 -2.98417999 -1.70485149 2.42705398
10 1 -3.2385531 -2.31833991 3.65784349
11 1 -3.90309128 -3.60021461 3.69407005
12 1 -4.28606826 -4.2158254 2.49809028
13 1 -2.85612827 -1.7037552 4.89565558
14 1 -4.15402415 -4.21171299 4.96649787
15 1 -3.1168224 -2.32256425 6.09211007
16 1 -3.77119247 -3.58945966 6.12778216
17 1 -3.38410309 -1.70829409 -4.96112745
18 1 -3.63466105 -2.32096365 -3.69002963
19 1 -4.29997504 -3.60215448 -3.65383746
20 1 -4.6855766 -4.21592547 -4.89012289
21 1 -4.42668281 -3.59525387 -6.08619031
22 1 -3.77053703 -2.32952441 -6.1219627
23 1 -8.31607959 -4.66003899 -2.42449517
24 1 -7.93536343 -5.27508701 -1.20605384
25 1 -7.27521448 -6.56446364 -1.24168193
26 1 -7.02700043 -7.17902739 -2.49413504
27 1 -8.18473118 -4.65980884 0.03589954
28 1 -6.89429707 -7.17982523 -0.03365955
29 1 -7.80246521 -5.27475723 1.24379059
30 1 -7.14233052 -6.5637977 1.2082259
31 1 -8.05011412 -4.66039244 2.49732523
32 1 -7.67066336 -5.27725776 3.69372244
33 1 -7.01200515 -6.56219016 3.6582494
34 1 -6.76068814 -7.17784073 2.42785092
35 1 -7.91991075 -4.66409609 4.96576415
36 1 -6.63185684 -7.17715977 4.89648639
37 1 -7.54001993 -5.28728307 6.12750036
38 1 -6.88994706 -6.55641113 6.09251318
39 1 -8.44692985 -4.66151417 -4.89106499
40 1 -8.06567245 -5.27684569 -3.65421034
41 1 -7.40800388 -6.562005 -3.68972191
42 1 -7.16122832 -7.177308 -4.96029115<tel:4.96029115>
43 1 -7.54362324 -6.55446214 -6.12157873
44 1 -8.19169174 -5.28455007 -6.08671076
45 1 -3.25026603 4.21460046 -2.49476966
46 1 -3.5021685 3.60225532 -1.2420043
47 1 -4.16890521 2.3162986 -1.2056959
48 1 -4.55355387 1.70297827 -2.42381044
49 1 -3.11810427 4.21656799 -0.03440088
50 1 -4.42095731 1.70299725 0.03664731
51 1 -3.36902389 3.60238813 1.20782615
52 1 -4.03553133 2.3166598 1.24418064
53 1 -2.98417453 4.21516367 2.42705556
54 1 -3.23855132 3.60168636 3.65785052
55 1 -3.90309645 2.31981562 3.69406688
56 1 -4.28606991 1.70419296 2.49809257
57 1 -2.85612361 4.21626686 4.89566928
58 1 -4.15399854 1.70830521 4.96648938
59 1 -3.1167815 3.59744336 6.09212848
60 1 -3.77112023 2.33052791 6.12777135
61 1 -3.3841027 4.2117061 -4.96112613
62 1 -3.6346605 3.59903694 -3.69002815
63 1 -4.29997467 2.31784616 -3.65383719
64 1 -4.68557624 1.704075 -4.89012299
65 1 -4.42668244 2.32474645 -6.08619052
66 1 -3.77053658 3.59047593 -6.12196162
67 1 -8.31607035 1.25994753 -2.42445468
68 1 -7.9353554 0.6449027<tel:0.6449027> -1.20599813
69 1 -7.27520561 -0.6444735<tel:0.6444735> -1.24161256
70 1 -7.02699906 -1.25902414 -2.49408402
71 1 -8.18471222 1.2601594 0.03597128
72 1 -6.89428975 -1.25983147 -0.03357367
73 1 -7.80244 0.64520434 1.24387294
74 1 -7.14230423 -0.64383584<tel:0.64383584> 1.20834546
75 1 -8.05006534 1.25953705 2.49742463
76 1 -7.67060893 0.64267715 3.69383428
77 1 -7.01194539 -0.64226303<tel:0.64226303> 3.65845391
78 1 -6.76065792 -1.2578769 2.42800214
79 1 -7.91990032 1.25587144 4.96584565
80 1 -6.63182708 -1.25718199 4.89678347
81 1 -7.54007346 0.63272364 6.1276186
82 1 -6.88997201 -0.63639636<tel:0.63639636> 6.09282446
83 1 -8.44692592 1.25848029 -4.89104651
84 1 -8.06566903 0.64315109<tel:0.64315109> -3.65418066
85 1 -7.4079997 -0.64200905<tel:0.64200905> -3.68968317
86 1 -7.16122786 -1.25730604 -4.96026403<tel:4.96026403>
87 1 -7.54362089 -0.63446444<tel:0.63446444> -6.12155816
88 1 -8.19169021 0.63544855<tel:0.63544855> -6.08669747
89 1 -3.25026653 10.13460018 -2.49477349
90 1 -3.50216946 9.52225389 -1.24200914
91 1 -4.16890582 8.23629694 -1.20570016
92 1 -4.55355485 7.6229768 -2.42381346
93 1 -3.11810573 10.13656543 -0.03440586
94 1 -4.42095891 7.62299265 0.0366413
95 1 -3.36902803 9.52238119 1.20781819
96 1 -4.03553596 8.23665323 1.24417507
97 1 -2.98418242 10.13515171 2.42704813
98 1 -3.23856759 9.52166856 3.65783688
99 1 -3.90311622 8.2397997 3.6940628
100 1 -4.28608271 7.62418174 2.49808457
101 1 -2.85614009 10.13625144 4.89564818
102 1 -4.15400145 7.62827621 4.96648623
103 1 -3.11678298 9.51741583 6.09209944
104 1 -3.7710943 8.25048934 6.12776572
105 1 -3.38410283 10.13170604 -4.96112861
106 1 -3.63466101 9.51903633 -3.69003137
107 1 -4.29997517 8.23784564 -3.65383928
108 1 -4.68557664 7.62407439 -4.89012413
109 1 -4.42668263 8.24474614 -6.08619127
110 1 -3.77053687 9.51047554 -6.12196359
111 1 -8.31608046 7.17996181 -2.42450212
112 1 -7.93536411 6.56491204 -1.20606326
113 1 -7.27521476 5.27553546 -1.24169111
114 1 -7.02699998 4.66097086 -2.49414166
115 1 -8.18473303 7.18019086 0.03588835
116 1 -6.89429642 4.66017092 -0.03367153
117 1 -7.80246318 6.5652398 1.24377517
118 1 -7.14232934 5.27619867 1.20821153
119 1 -8.05010676 7.17960604 2.49730733
120 1 -7.67064893 6.56273632 3.69369721
121 1 -7.01199557 5.27780174 3.65822897
122 1 -6.7606839 4.66215043 2.42783226
123 1 -7.91992051 7.1758881 4.9657332
124 1 -6.63184554 4.66282835 4.89646306
125 1 -7.54006046 6.55268023 6.12746328
126 1 -6.88995798 5.28356943 6.09248756
127 1 -8.44693031 7.17848621 -4.8910686
128 1 -8.06567255 6.56315395 -3.65421568
129 1 -7.40800411 5.27799471 -3.68972664
130 1 -7.16122824 4.66269125 -4.96029412<tel:4.96029412>
131 1 -7.54362339 5.28553774 -6.1215808
132 1 -8.19169185 6.55544966 -6.08671348
133 1 4.28973068 -1.70541554 -2.49468399
134 1 4.03783732 -2.31774528 -1.24188701
135 1 3.37109997 -3.60370092 -1.20557569
136 1 2.98645916 -4.21700595 -2.4237237
137 1 4.42189032 -1.70345576 -0.03425231
138 1 3.11906044 -4.2169772 0.03679934
139 1 4.17098551 -2.31761235 1.20801694
140 1 3.50448113 -3.60333987 1.24437695
141 1 4.55582526 -1.70486981 2.42729156
142 1 4.30149089 -2.31830684 3.65815237
143 1 3.6369523 -3.60019835 3.69437762
144 1 3.25398063 -4.21577647 2.49833857
145 1 4.68392396 -1.70371273 4.89601378
146 1 3.38600367 -4.21166241 4.9668644
147 1 4.42321169 -2.32249555 6.09251833
148 1 3.76880441 -3.58936669 6.12817303
149 1 4.15589573 -1.70830089 -4.96108408
150 1 3.90534312 -2.32096235 -3.68996475
151 1 3.24002846 -3.60215477 -3.65377258
152 1 2.8544297 -4.21591788 -4.89008064
153 1 3.11331864 -3.59525445 -6.08615932
154 1 3.76946539 -2.3295232 -6.1219308
155 1 -0.77608037 -4.66003822 -2.42450269
156 1 -0.39536402 -5.27508805 -1.20606395
157 1 0.26478535 -6.56446462 -1.24169174
158 1 0.51300014 -7.17902929 -2.49414217
159 1 -0.64473286 -4.65980922 0.03588759
160 1 0.64570371 -7.17982935 -0.03367229
161 1 -0.26246301 -5.27476057 1.24377416
162 1 0.39767092 -6.56380163 1.2082107
163 1 -0.51010657 -4.6603946 2.49730623
164 1 -0.13064888 -5.27726497 3.6936956
165 1 0.5280045 -6.5621995 3.65822778
166 1 0.77931625 -7.17785048 2.42783111
167 1 -0.3799188 -4.66411229 4.96573115
168 1 0.90815416 -7.17717338 4.89646166
169 1 -0.00005708 -5.28731944 6.1274607
170 1 0.65004362 -6.55643108 6.09248588
171 1 -0.90693017 -4.66151384 -4.89106894
172 1 -0.52567246 -5.27684615 -3.65421614
173 1 0.13199598 -6.56200536 -3.68972706
174 1 0.37877193 -7.17730885 -4.96029438
175 1 -0.00362324 -6.55446234 -6.12158101
176 1 -0.6516917 -5.28455044 -6.08671375
177 1 4.28973388 4.21460138 -2.4947778
178 1 4.03783039 3.60225472 -1.24201506
179 1 3.37109372 2.31629786 -1.20570699
180 1 2.98644477 1.70297631 -2.42381848
181 1 4.4218949 4.2165683 -0.03441349
182 1 3.11903987 1.70299326 0.036633
183 1 4.17097278 3.60238422 1.20780919
184 1 3.50446543 2.31665581 1.24416358
185 1 4.55582107 4.21515741 2.4270369
186 1 4.30143987 3.60167187 3.65782391
187 1 3.63689548 2.31980133 3.69404315
188 1 3.25392346 1.70418176 2.49807016
189 1 4.68386699 4.21625231 4.89563641
190 1 3.38599024 1.70828299 4.96646044
191 1 4.42320409 3.59742127 6.0920852
192 1 3.76886831 2.330508 6.12773912
193 1 4.15589715 4.21170651 -4.96113054
194 1 3.90533891 3.59903652 -3.69003446
195 1 3.24002491 2.31784588 -3.65384309
196 1 2.85442318 1.70407417 -4.89012672
197 1 3.11331733 2.32474631 -6.08619328
198 1 3.76946301 3.59047564 -6.12196502
199 1 -0.77607974 1.25996083 -2.42449878
200 1 -0.39536351 0.64491157 -1.20605862
201 1 0.26478589 -0.64446492 -1.2416865
202 1 0.51300008 -1.25902894 -2.49413816
203 1 -0.64473137 1.26018885 0.03589437
204 1 0.64570439 -1.25982925 -0.03366623
205 1 -0.26246171 0.64523729 1.24378221
206 1 0.39767185 -0.64380393 1.20821889
207 1 -0.51010374 1.25959981 2.49731665
208 1 -0.13064701 0.64272734 3.69370669
209 1 0.52800499 -0.64220813 3.65824082
210 1 0.7793163 -1.25785458 2.42784034
211 1 -0.37991502 1.2558774 4.96574413
212 1 0.90816306 -1.25717735 4.8964775
213 1 -0.00004659 0.63267546 6.12747511
214 1 0.65006495 -0.6364321 6.09250537
215 1 -0.90692992 1.2584858 -4.89106707
216 1 -0.52567228 0.64315376 -3.65421321
217 1 0.13199614 -0.64200558 -3.68972389
218 1 0.37877185 -1.25730867 -4.96029217
219 1 -0.00362315 -0.63446246 -6.12157929
220 1 -0.65169165 0.63544956 -6.08671236
221 1 4.28973393 10.13460128 -2.49477798
222 1 4.03783055 9.52225459 -1.24201528
223 1 3.3710938 8.23629774 -1.20570718
224 1 2.98644472 7.62297625 -2.42381864
225 1 4.4218949 10.13656813 -0.03441362
226 1 3.11903979 7.62299309 0.03663289
227 1 4.17097317 9.52238386 1.20780898
228 1 3.50446574 8.23665543 1.24416343
229 1 4.55582084 10.1351572 2.4270368
230 1 4.3014397 9.52167167 3.65782375
231 1 3.63689508 8.23980109 3.69404333
232 1 3.25392322 7.62418154 2.49807019
233 1 4.68386586 10.13625268 4.89563628
234 1 3.38598851 7.62828338 4.96646077
235 1 4.42320336 9.5174209 6.09208489
236 1 3.76886708 8.25050774 6.12773955
237 1 4.15589726 10.13170642 -4.96113073
238 1 3.90533899 9.51903647 -3.69003469
239 1 3.24002494 8.23784586 -3.65384331
240 1 2.8544232 7.62407416 -4.89012689
241 1 3.11331741 8.24474629 -6.08619346
242 1 3.76946311 9.51047556 -6.12196522
243 1 -0.77607152 7.1799533 -2.42442199
244 1 -0.39536387 6.56492152 -1.20595262
245 1 0.26478458 5.27554554 -1.24159438
246 1 0.51299437 4.66098997 -2.49407089
247 1 -0.64472666 7.18018767 0.03602593
248 1 0.64568854 4.66021001 -0.03354685
249 1 -0.26247324 6.56527836 1.24396352
250 1 0.39765836 5.27623874 1.20836138
251 1 -0.51009835 7.17963764 2.497543
252 1 -0.13065023 6.56282949 3.69401113
253 1 0.52800144 5.27788331 3.65844663
254 1 0.77929045 4.66224121 2.42801686
255 1 -0.37991457 7.17590985 4.96615774
256 1 0.90814886 4.66285739 4.89666542
257 1 -0.00009418 6.55261644 6.12791538
258 1 0.65000234 5.28350882 6.09273647
259 1 -0.90692596 7.17848175 -4.89102735
260 1 -0.52567154 6.56315821 -3.65415492
261 1 0.1319971 5.27799768 -3.68967498
262 1 0.37876942 4.66269922 -4.96026096
263 1 -0.00362276 5.28553877 -6.12155699
264 1 -0.65169162 6.55545221 -6.08668231
265 1 11.82973426 -1.70540412 -2.49472067
266 1 11.57783992 -2.31773792 -1.24193727
267 1 10.9111023 -3.60369413 -1.20564051
268 1 10.52645439 -4.21700995 -2.42377019
269 1 11.96190263 -1.70343229 -0.03431678
270 1 10.6590609 -4.21697772 0.03671755
271 1 11.71099547 -2.31758464 1.20794079
272 1 11.04448747 -3.60331251 1.24426434
273 1 12.09583428 -1.70481352 2.42720288
274 1 11.84146654 -2.31825574 3.65804418
275 1 11.17691968 -3.60013578 3.6941873
276 1 10.79395998 -4.21575133 2.49819244
277 1 12.2238966 -1.70373586 4.89594166
278 1 10.92600284 -4.2116906 4.9665878
279 1 11.96325591 -2.32263157 6.09240533
280 1 11.30888953 -3.58953532 6.12790394
281 1 11.69589735 -1.70829643 -4.96110091
282 1 11.44534295 -2.32096005 -3.68999143
283 1 10.78002814 -3.6021517 -3.65380751
284 1 10.39442734 -4.21592031 -4.89010424
285 1 10.65331882 -3.59525288 -6.0861769
286 1 11.30946541 -2.32952249 -6.12194272
287 1 6.76391973 -4.66003798 -2.42450263
288 1 7.14463616 -5.27508778 -1.20606393
289 1 7.80478552 -6.56446436 -1.24169178
290 1 8.05300027 -7.17902904 -2.49414218
291 1 6.89526719 -4.65980891 0.03588762
292 1 8.18570392 -7.17982907 -0.03367234
293 1 7.27753717 -5.27476017 1.24377416
294 1 7.93767119 -6.56380122 1.20821057
295 1 7.02989332 -4.66039416 2.49730621
296 1 7.40935137 -5.27726416 3.69369568
297 1 8.06800522 -6.5621985 3.65822753
298 1 8.31931669 -7.17784983 2.42783103
299 1 7.16008095 -4.66411145 4.96573119
300 1 8.44815481 -7.17717235 4.89646146
301 1 7.53994384 -5.28731792 6.12746069
302 1 8.19004416 -6.55642963 6.09248539
303 1 6.63306991 -4.66151366 -4.89106891
304 1 7.01432773 -5.27684588 -3.65421611
305 1 7.67199615 -6.56200509 -3.68972708
306 1 7.91877195 -7.1773086 -4.96029441
307 1 7.53637683 -6.55446209 -6.12158107
308 1 6.8883084 -5.2845502 -6.08671376
309 1 11.82973402 4.21460126 -2.49477786
310 1 11.57783052 3.60225457 -1.24201513
311 1 10.91109378 2.31629775 -1.20570699
312 1 10.52644477 1.70297617 -2.42381846
313 1 11.96189508 4.21656812 -0.03441363
314 1 10.65903991 1.70299311 0.03663295
315 1 11.71097296 3.60238398 1.20780903
316 1 11.04446559 2.31665561 1.24416351
317 1 12.09582103 4.21515724 2.42703671
318 1 11.84143985 3.60167157 3.65782365
319 1 11.17689565 2.31980095 3.69404313
320 1 10.79392347 1.70418152 2.49807007
321 1 12.22386706 4.216252 4.8956361
322 1 10.92598982 1.70828284 4.96646042
323 1 11.96320512 3.5974201 6.09208473
324 1 11.30886857 2.33050713 6.12773934
325 1 11.69589729 4.21170646 -4.96113053
326 1 11.44533903 3.59903639 -3.69003447
327 1 10.78002496 2.31784577 -3.65384304
328 1 10.39442312 1.70407403 -4.89012665
329 1 10.65331733 2.32474622 -6.08619316
330 1 11.30946307 3.59047554 -6.12196494
331 1 6.76391974 1.25996195 -2.42450257
332 1 7.14463608 0.64491214 -1.20606385
333 1 7.80478534 -0.64446445 -1.2416917
334 1 8.05300016 -1.25902914 -2.49414211
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725 1 0.73829064 -2.50599032 11.80513738
726 1 1.16573994 -3.84648198 11.8055877
727 1 3.05798462 -5.23695024 11.80655062
728 1 4.46485404 -5.24434378 11.80741919
729 1 2.33074706 -5.4685744 13.04106277
730 1 1.16109361 -4.60928959 13.04033434
731 1 5.18852468 -5.48349012 13.04267624
732 1 6.36714104 -4.63645551 13.04309889
733 1 7.26361922 -1.92253322 13.04329388
734 1 6.82266079 -0.54006848 13.04292775
735 1 4.51980673 1.15256113 13.04149675
736 1 3.06850195 1.16024796 13.04063924
737 1 0.74810808 -0.50836626 13.03964642
738 1 0.29287708 -1.88618447 13.03934372
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740 1 4.4834825 -5.70852482 14.23930259
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742 1 7.25921462 -2.66227317 14.24065559
743 1 6.39104137 0.06087859 14.23976431
744 1 5.22073705 0.91927235 14.23895572
745 1 1.18461243 0.08812762 14.236994
746 1 2.36383201 0.93431269 14.23734912
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748 1 0.28822269 -2.62590464 14.23670485
749 1 4.93444981 -5.09343133 15.47434167
750 1 6.07685237 -4.27230957 15.47495289
751 1 1.45242057 -4.24815522 15.47246264
752 1 2.58618094 -5.08119137 15.47301341
753 1 0.73857397 -2.01079995 15.47152981
754 1 1.18013372 -0.67485367 15.47168673
755 1 3.08706703 0.6957079 15.4726909
756 1 4.4939513 0.68827878 15.47354195
757 1 6.81392486 -2.04250248 15.47494078
758 1 6.3864257 -0.70201565 15.47450752
759 1 3.76191528 -4.70566601 16.23684452
760 1 1.45842465 -3.01340963 16.2354666
761 1 2.35581029 -0.29932208 16.23556602
762 1 5.21390649 -0.3143755 16.23707471
763 1 6.08294496 -3.03755622 16.2380041
764 1 3.05362293 -1.27116055 16.97599873
765 1 4.50506584 -1.27872174 16.97674129
766 1 4.94644542 -2.66153304 16.97718987
767 1 3.76786921 -3.5087267 16.97658203
768 1 2.5980812 -2.64939323 16.97585952
769 1 18.05285858 5.39565257 10.30320585
770 1 19.50429782 5.38804134 10.30404975
771 1 19.95984516 6.76619997 10.30419839
772 1 18.79003285 7.62558788 10.30297634
773 1 17.61139102 6.77840813 10.30255566
774 1 16.47486815 7.15444001 11.04174884
775 1 17.34402921 4.43133496 11.04286603
776 1 20.20218089 4.4163027 11.04456819
777 1 21.09954834 7.130136 11.04463942
778 1 18.79597285 8.82237818 11.04300026
779 1 21.37799233 4.79177321 11.80831051
780 1 21.81970513 6.12763427 11.80845461
781 1 21.10555699 8.36487061 11.8075906
782 1 19.97169757 9.19783056 11.8068793
783 1 17.62340876 9.21027977 11.80541005
784 1 16.48095442 8.38921266 11.80479116
785 1 15.74390552 6.15939225 11.80485563
786 1 16.17146279 4.81892639 11.80537021
787 1 18.0640243 3.42877007 11.80646495
788 1 19.47090505 3.42134363 11.80745489
789 1 17.33712594 3.1977064 13.0409666
790 1 16.16679141 4.05604975 13.04011438
791 1 20.19438793 3.18239464 13.04266873
792 1 21.37353608 4.02875488 13.04303438
793 1 22.27067564 6.742791 13.04326721
794 1 21.82915471 8.12535057 13.04283319
795 1 19.5257021 9.81762024 13.04133045
796 1 18.0743358 9.82541789 13.04044107
797 1 15.75373533 8.15709311 13.03934706
798 1 15.29851744 6.77920164 13.03909101
799 1 18.03811317 2.96441243 14.23835885
800 1 19.48946339 2.95683234 14.23926145
801 1 21.81034797 4.62523195 14.24022619
802 1 22.26605282 6.00313789 14.24046324
803 1 21.39700211 8.72623587 14.23941284
804 1 20.22718866 9.58539675 14.23862635
805 1 16.19053704 8.75344816 14.23661248
806 1 17.36919163 9.60045639 14.23702803
807 1 15.73504888 4.65700392 14.23690181
808 1 15.29405234 6.03948148 14.23647827
809 1 19.94043369 3.5720388 15.47422057
810 1 21.08289167 4.39317004 15.47466338
811 1 16.45828526 4.4171935 15.47231239
812 1 17.5920861 3.58417454 15.47293132
813 1 15.74445475 6.6546101 15.47127499
814 1 16.18601243 7.99057306 15.47132868
815 1 18.0929284 9.36125834 15.47224131
816 1 19.4998284 9.35375073 15.47303274
817 1 21.82009035 6.62298906 15.47467491
818 1 21.39236823 7.96338079 15.47417628
819 1 18.76784233 3.95967746 16.23672652
820 1 16.46427188 5.65198976 16.23524196
821 1 17.36170413 8.36618284 16.23512854
822 1 20.21972641 8.35105857 16.236558
823 1 21.08887037 5.62798925 16.23756232
824 1 18.05947406 7.39426748 16.9755257
825 1 19.51086183 7.38668546 16.9761642
826 1 19.95228612 6.00393397 16.9766871
827 1 18.77375027 5.15670294 16.97632225
828 1 17.60395214 6.01602571 16.97557546
829 1 13.05278007 -3.2696575 10.3034616
830 1 14.50416722 -3.27721949 10.30431606
831 1 14.95977289 -1.8990374 10.3043254
832 1 13.78997797 -1.03972474 10.30345215
833 1 12.61130563 -1.8868468 10.30252778
834 1 11.47490685 -1.51088612 11.0419846
835 1 12.34398111 -4.23411865 11.04305966
836 1 15.20196041 -4.24904399 11.04479414
837 1 16.09944238 -1.53513744 11.0448598
838 1 13.79593525 0.15728628 11.04308765
839 1 16.37775606 -3.87349397 11.80852241
840 1 16.81956216 -2.53766655 11.80864873
841 1 16.10549038 -0.30040703 11.80781411
842 1 14.97164689 0.53257278 11.80706999
843 1 12.62337237 0.54504549 11.80557876
844 1 11.48096224 -0.27608512 11.80499791
845 1 10.74398497 -2.50596519 11.80505906
846 1 11.17144757 -3.84646948 11.80557249
847 1 13.06383507 -5.23681264 11.806659
848 1 14.47071712 -5.24410259 11.807636
849 1 12.33650378 -5.46851704 13.04108414
850 1 11.1668008 -4.60928881 13.04032556
851 1 15.19447185 -5.48330974 13.04279618
852 1 16.37323453 -4.63641151 13.04323381
853 1 17.27062513 -1.92255763 13.04346011
854 1 16.82905336 -0.54006966 13.0430826
855 1 14.52563344 1.15238863 13.04157571
856 1 13.07430865 1.1601985 13.04066941
857 1 10.75382133 -0.50834349 13.03959014
858 1 10.29858252 -1.8861704 13.03929481
859 1 13.03793523 -5.7007916 14.23842166
860 1 14.48930373 -5.70836355 14.23930569
861 1 16.81035194 -4.04013168 14.24036812
862 1 17.26615973 -2.66222737 14.24066751
863 1 16.39712845 0.06084705 14.23977904
864 1 15.22666351 0.91907896 14.23893727
865 1 11.19033027 0.08813265 14.23695844
866 1 12.36958665 0.93427062 14.23733318
867 1 10.73487266 -4.00843531 14.23705994
868 1 10.29392124 -2.62589722 14.2366711
...
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