vasp
6.4.1
05Apr23 (build Apr 16 2023 21:42:41) complex parallel
Lin64
2025 07 14
20:34:12
(C129N6O21H85)2 (P1) _ODPABAPP_6_Optical
0
Normal
Normal (blocked Davidson)
F
1
11
1
60
2
-1
0.00001000
0
0
400.00000000
2997
3000
0.77000000 0.32000000 0.73000000 0.75000000
F
0
0.05000000
1
F
F
T
F
0.10000000
1
17.16304694 0.00000000 0.00000000
0.00000000 17.16304694 0.00000000
0.00000000 0.00000000 17.16304694
5055.72183101
0.05826471 0.00000000 0.00000000
0.00000000 0.05826471 0.00000000
0.00000000 0.00000000 0.05826471
0.50837469 0.03393992 0.44925660
0.56101576 0.07727653 0.40445413
0.60102449 0.03959159 0.34637540
0.49610952 0.95454220 0.43499785
0.53132797 0.91918964 0.37118679
0.58177373 0.96361851 0.32630388
0.53903416 0.98930093 0.21285914
0.55219945 0.06838267 0.19992310
0.48871054 0.11796700 0.19398094
0.46389197 0.95984705 0.21333033
0.40066244 0.00998103 0.20637480
0.41180336 0.08988885 0.19579370
0.34256897 0.14450263 0.18656455
0.36415814 0.20821049 0.12768549
0.34269210 0.20221306 0.04943396
0.36244883 0.25778198 0.99315386
0.40914115 0.27367441 0.14771887
0.43127713 0.32845813 0.09237049
0.40672634 0.32203937 0.01521204
0.47482258 0.43796590 0.97890328
0.44575864 0.51309257 0.97046471
0.48991043 0.57602817 0.99487645
0.55136594 0.42646857 0.00495566
0.59548610 0.48925194 0.03087743
0.56276966 0.56343905 0.02862296
0.26918971 0.10050588 0.15915857
0.32325343 0.17758709 0.26730796
0.11361700 0.23926841 0.58517972
0.12992805 0.10471553 0.60174888
0.16459127 0.14584318 0.66928745
0.21349086 0.11560016 0.72547044
0.25287808 0.16779554 0.77367982
0.37989850 0.12590919 0.75947463
0.44750969 0.17095429 0.76313710
0.50107088 0.16607529 0.70258576
0.48151446 0.12424418 0.63729741
0.51639108 0.12662319 0.56009763
0.41083171 0.04018520 0.55803980
0.41795221 0.07454456 0.63681100
0.36879424 0.06956791 0.70066085
0.23039785 0.24595522 0.77729381
0.18228116 0.27581765 0.71897225
0.15294993 0.22604957 0.66182641
0.83101677 0.29081475 0.27483107
0.86118477 0.33579414 0.21420560
0.83124765 0.40836687 0.19686883
0.77258880 0.32169220 0.32177422
0.74602524 0.39665747 0.30779162
0.77655538 0.44049188 0.24774957
0.81262813 0.56979235 0.22781400
0.78824339 0.64560564 0.21465117
0.84175799 0.69797603 0.18550502
0.89147809 0.55052907 0.22287117
0.94272428 0.60226134 0.18827058
0.91747880 0.67601898 0.16629879
0.96828519 0.73442826 0.12427410
0.93491314 0.74010989 0.04085747
0.94764843 0.68144900 0.98476246
0.91739033 0.68696812 0.90949956
0.88979511 0.80304560 0.01728797
0.85714309 0.80855633 0.94327318
0.87015355 0.75028508 0.88910815
0.76802107 0.71870574 0.80431304
0.76432451 0.64148325 0.82841618
0.69373671 0.60317751 0.82876797
0.70245678 0.75476377 0.77221082
0.63216787 0.71337685 0.76698221
0.62630385 0.63815242 0.79815465
0.96824683 0.81017181 0.17340232
0.05206841 0.70688589 0.12069804
0.62117198 0.68948063 0.00226260
0.61540952 0.65540166 0.13313697
0.65753064 0.73129104 0.12437799
0.68566184 0.78254462 0.17955942
0.73072241 0.84461207 0.15184292
0.79887187 0.95987117 0.20149901
0.85352688 0.98053601 0.14424464
0.89436562 0.05038246 0.14931995
0.87846760 0.09910887 0.21094237
0.90877422 0.17655987 0.23010978
0.79479732 0.15464493 0.30106319
0.81743504 0.08231815 0.26163870
0.77824376 0.01245656 0.25996921
0.74103502 0.85813142 0.07234970
0.70617411 0.80988534 0.01779486
0.66608074 0.74611254 0.04504384
0.23124441 0.35252117 0.31663105
0.29099366 0.38307369 0.27134427
0.27983611 0.39182084 0.19288655
0.15907016 0.33400991 0.28389330
0.14654633 0.34440042 0.20395362
0.20897179 0.37179439 0.15899503
0.18071130 0.34444917 0.02279759
0.13844896 0.27544156 0.02864588
0.09485803 0.25230322 0.96379894
0.19585543 0.37563656 0.94919166
0.14481151 0.35755594 0.88940248
0.08764610 0.30089653 0.89859926
0.01511853 0.29900741 0.84860398
0.94614037 0.32444319 0.89923701
0.87186371 0.33260376 0.86690805
0.80556530 0.33102955 0.91334099
0.95289204 0.33278772 0.97986344
0.88731944 0.32875449 0.02655978
0.81509756 0.32077349 0.99248732
0.74416008 0.21222360 0.02232386
0.68547121 0.17734270 0.06595930
0.66310015 0.10231120 0.04861062
0.78701458 0.16675704 0.96901134
0.76552597 0.08939340 0.95398358
0.70025231 0.05782252 0.99132118
0.01755756 0.35628216 0.78007996
0.00111609 0.21239194 0.82594254
0.47596621 0.61840363 0.80166734
0.55776103 0.51205031 0.80636675
0.47808972 0.48385267 0.79682774
0.45673962 0.40847162 0.78052830
0.38242348 0.39904791 0.74917051
0.35248230 0.31393340 0.63959965
0.33548105 0.23557108 0.62477029
0.30919060 0.20759551 0.55407351
0.29904748 0.26258830 0.49637090
0.25389968 0.25734667 0.42417643
0.29788227 0.38413955 0.43949716
0.32097906 0.33962168 0.50912933
0.34959719 0.36860490 0.57916106
0.32759987 0.45889931 0.75530891
0.34853952 0.53241210 0.78410957
0.42742139 0.54689158 0.79642264
0.27889288 0.81377524 0.44582884
0.32403211 0.83388962 0.51063895
0.29366381 0.82809412 0.58548587
0.20151753 0.79125700 0.45762000
0.17048733 0.78554955 0.53233300
0.21799298 0.80145314 0.59672281
0.20899644 0.82851161 0.73401238
0.17390853 0.90118924 0.73907806
0.18335447 0.94670160 0.80574137
0.25302088 0.80093902 0.79691849
0.26296781 0.84832502 0.86222252
0.23147120 0.92350833 0.86715954
0.25018035 0.97495898 0.93744732
0.33804215 0.99090416 0.94415195
0.37461590 0.99940690 0.01677456
0.44375124 0.04048711 0.02428601
0.38510159 0.00597392 0.87960335
0.45607644 0.04534764 0.88565795
0.47796185 0.07360060 0.95863945
0.56505533 0.17758228 0.91753586
0.56426965 0.25785955 0.92821731
0.59589210 0.30762494 0.87201840
0.60528244 0.14668292 0.85475964
0.63635406 0.19665547 0.79912716
0.62828134 0.27738869 0.80303318
0.20674524 0.05361174 0.93025283
0.21877162 0.93495515 0.01007526
0.63702883 0.95610502 0.89964085
0.62090243 0.94851987 0.03355777
0.56391674 0.89785521 0.99756832
0.50616706 0.85827581 0.03665845
0.44876424 0.82227067 0.99209054
0.38460685 0.77990774 0.10906802
0.44876656 0.74525321 0.14520951
0.45704699 0.74302199 0.22595929
0.39592621 0.77250836 0.26973150
0.38604401 0.77511927 0.35518023
0.27313171 0.82225555 0.29850950
0.32862625 0.80140946 0.23463600
0.32096286 0.80596932 0.15375057
0.45405579 0.82527768 0.91022163
0.51444125 0.86492506 0.87172897
0.57055895 0.90280446 0.91685451
0.31868825 0.57290802 0.15732049
0.26451124 0.63265347 0.16916836
0.21784004 0.65799291 0.10839346
0.31855118 0.53689967 0.08418456
0.26902930 0.55979500 0.02404397
0.21816499 0.62194783 0.03521211
0.15182354 0.62767734 0.90661675
0.12569646 0.68457995 0.85479486
0.10710865 0.66558938 0.77833742
0.15607341 0.55087592 0.88083320
0.14072080 0.53412487 0.80272362
0.11650722 0.59006499 0.74894129
0.11574935 0.57316060 0.66056564
0.19693649 0.59155774 0.62861692
0.24972307 0.62872413 0.67682561
0.32786256 0.63408516 0.65982495
0.22449516 0.56563204 0.55592971
0.30229221 0.57617677 0.53508762
0.35447320 0.60821757 0.58832625
0.47350478 0.67883652 0.57731855
0.53889129 0.68908787 0.53014081
0.58053471 0.75796088 0.53104224
0.45137401 0.73890130 0.62732265
0.49137564 0.80856625 0.62678911
0.55621360 0.81901718 0.57896515
0.10285917 0.48660835 0.64486805
0.05443610 0.62173243 0.61600313
0.70577317 0.38612152 0.72996498
0.59306164 0.33820932 0.67307766
0.62357468 0.40134636 0.62455025
0.59304530 0.43185901 0.55743189
0.62269604 0.50348664 0.53375811
0.54555937 0.50580878 0.41474567
0.56766407 0.44220423 0.36881019
0.53105240 0.43059784 0.29725427
0.47157982 0.48154321 0.27791866
0.43731845 0.50156825 0.20284225
0.37095791 0.57210166 0.29605027
0.43988904 0.53290656 0.33169788
0.47654484 0.54724483 0.40174079
0.67684084 0.54483125 0.57961655
0.70977446 0.51060367 0.64502569
0.68425567 0.43654699 0.66427477
0.89338356 0.48140257 0.43678314
0.96816333 0.49071545 0.40497915
0.99111354 0.56242126 0.37422521
0.84160567 0.54404124 0.43710248
0.86475979 0.61568777 0.40758248
0.93927124 0.62557055 0.37639317
0.94315599 0.76517140 0.37837622
0.00468825 0.81282325 0.40176421
0.99126606 0.87371973 0.45319402
0.86671881 0.78965413 0.39145522
0.85384516 0.85063161 0.44369783
0.91579604 0.88853063 0.48043176
0.90534901 0.93815815 0.55231330
0.95981548 0.91080642 0.61656440
0.96548290 0.83055309 0.63263835
0.98103956 0.80514918 0.70725530
0.98133140 0.96376464 0.67391098
0.99842400 0.93919572 0.74840419
0.99352005 0.86017680 0.76559786
0.00446092 0.87824024 0.90222188
0.95864479 0.94511049 0.91134788
0.96400195 0.98774248 0.98010367
0.04874034 0.85056565 0.96361187
0.05408704 0.89384755 0.03121492
0.01398882 0.96359472 0.03935562
0.91544094 0.02529727 0.53186031
0.82574644 0.92296969 0.59155804
0.64460090 0.91939962 0.52058510
0.59049369 0.94394295 0.64197993
0.64358923 0.00671938 0.62140286
0.67284271 0.06192671 0.67099034
0.72562541 0.11333834 0.63756521
0.79877954 0.22493866 0.65228652
0.87461854 0.23094547 0.67781139
0.92571087 0.28302130 0.64308768
0.89542110 0.32724183 0.58294194
0.93123575 0.39005660 0.53781880
0.80352389 0.37820664 0.49570285
0.81784821 0.32095929 0.55889429
0.76598251 0.27082486 0.59391387
0.74784734 0.10880286 0.55909774
0.71904021 0.05050801 0.51142891
0.66787961 0.99780259 0.54479618
0.63893300 0.07418499 0.30927156
0.57188326 0.13872115 0.41421335
0.45824560 0.92086239 0.47301661
0.51687626 0.85989787 0.35306074
0.50030074 0.17970656 0.18588237
0.61124126 0.09185974 0.19883758
0.45575708 0.89831532 0.22734348
0.34196382 0.98538668 0.21072251
0.34378045 0.25029468 0.93278442
0.31059455 0.15194998 0.02912741
0.42803674 0.28307318 0.20732570
0.46625404 0.37805525 0.11024722
0.46672140 0.63511229 0.99148975
0.38635371 0.52210061 0.95067360
0.57707735 0.36866632 0.00780144
0.65446454 0.47980951 0.05293382
0.22013131 0.14090142 0.15273084
0.25137291 0.05518469 0.20071163
0.27887814 0.07183045 0.10304462
0.27040645 0.21333561 0.26304672
0.37040321 0.21343125 0.29221850
0.31063298 0.13003865 0.30821463
0.22435817 0.05327064 0.72939534
0.45652415 0.21233150 0.81072001
0.55454410 0.19791291 0.70272962
0.32063869 0.02858160 0.70006309
0.25232522 0.28325073 0.82396211
0.16997723 0.33813970 0.71667932
0.85445947 0.44068427 0.14731428
0.90949229 0.31298582 0.18103868
0.74938108 0.28794468 0.36941010
0.70468775 0.42435972 0.34635292
0.82450938 0.75772804 0.17630502
0.72808852 0.66121201 0.22639472
0.91327115 0.49578647 0.24528514
0.00328872 0.58411600 0.18133747
0.93127213 0.64218648 0.86656737
0.98218052 0.62998273 0.99874814
0.88208490 0.85127647 0.05715303
0.82299870 0.85931807 0.92653007
0.69171493 0.54532405 0.85404869
0.81557982 0.61146052 0.85054579
0.70516098 0.81581900 0.75346591
0.58147657 0.74151809 0.74140361
0.00807450 0.85458855 0.15142134
0.98780585 0.79602853 0.23267419
0.91098387 0.83754682 0.17869286
0.08644418 0.74967224 0.08823990
0.05949378 0.65116579 0.09057598
0.07611244 0.70117868 0.17967609
0.67719453 0.77509284 0.24219918
0.86653685 0.94243444 0.09584048
0.93418500 0.06899396 0.10400541
0.73105605 0.99747886 0.29930819
0.77093873 0.90970870 0.05162303
0.70845195 0.82175320 0.95538345
0.32576588 0.41203120 0.15487409
0.34670821 0.39677727 0.29792336
0.11330964 0.30876822 0.32040025
0.08917223 0.33123362 0.18034288
0.05880960 0.20062346 0.96973584
0.13243996 0.24453783 0.08395772
0.24282663 0.41766561 0.94123801
0.14793037 0.38982382 0.83527026
0.74812317 0.33094635 0.88697268
0.86327314 0.33661333 0.80432499
0.00926769 0.33591590 0.00817830
0.89257252 0.32467163 0.08892326
0.61273018 0.07916636 0.07744596
0.65456577 0.21149759 0.10978629
0.83624186 0.19112228 0.93704898
0.79902704 0.05650941 0.91103287
0.96008491 0.35935024 0.75274423
0.05901298 0.34126430 0.73382242
0.03037793 0.41588239 0.79984522
0.96463984 0.20653644 0.77457361
0.97143150 0.18141148 0.87375341
0.05585607 0.18127231 0.81340537
0.49618869 0.35975345 0.78759340
0.33694562 0.19735968 0.67370263
0.29206073 0.14708264 0.54590198
0.36155117 0.43036898 0.58612267
0.26872077 0.45066028 0.73242774
0.30306539 0.57558529 0.79259390
0.33017364 0.84055147 0.63586493
0.38434087 0.85091808 0.50417032
0.16686688 0.77636543 0.40685862
0.11028028 0.76668001 0.53974476
0.15177695 0.00134616 0.80839897
0.13694011 0.92040769 0.69110893
0.27878991 0.74267716 0.79639651
0.29613552 0.82656444 0.91134403
0.47116405 0.04952056 0.08068441
0.35068883 0.97392308 0.06950836
0.36454328 0.98780667 0.82273261
0.49131987 0.05440227 0.83416716
0.59620896 0.37013190 0.88153196
0.53605985 0.27850026 0.98083502
0.61269087 0.08436210 0.84843113
0.66563082 0.17196754 0.74953858
0.21318828 0.08995212 0.98237033
0.14427621 0.04278357 0.92259445
0.22723879 0.08802745 0.88100046
0.23649747 0.96217760 0.06487042
0.23265450 0.87252122 0.01098480
0.15622365 0.94129870 0.00604353
0.50455971 0.85958037 0.09987170
0.49313178 0.72036430 0.10779535
0.50938208 0.71907127 0.25315896
0.26695837 0.82694582 0.12783013
0.40890474 0.79946613 0.87417467
0.51500148 0.86895724 0.80801553
0.17962718 0.70701003 0.11840612
0.25869605 0.65999385 0.22582440
0.35864139 0.48981136 0.07303510
0.27139582 0.52838813 0.96909674
0.09179041 0.71282162 0.73930476
0.12368774 0.74493877 0.87338078
0.17150344 0.50418000 0.92028648
0.15112942 0.47543661 0.78223032
0.36614070 0.65491478 0.70519926
0.23046220 0.65088894 0.73246886
0.18675178 0.53517909 0.51482212
0.32292736 0.55630447 0.47867223
0.62918715 0.76493734 0.49160907
0.55638370 0.64451579 0.48900902
0.40202810 0.73577781 0.66595831
0.47124838 0.85444504 0.66534562
0.10095983 0.47563353 0.58239424
0.04778565 0.46585992 0.66937167
0.15142098 0.45164595 0.66764873
0.05648614 0.60626680 0.55394164
0.06685619 0.68418780 0.62062810
0.99494199 0.61072797 0.63701865
0.54881806 0.40048005 0.52453209
0.61673886 0.40627964 0.38674355
0.55082181 0.38671740 0.25574397
0.45486050 0.59072202 0.44232655
0.69010534 0.60471879 0.56325645
0.74922287 0.54028541 0.68499523
0.04907844 0.56898272 0.34807017
0.01060511 0.44340850 0.40748585
0.78374544 0.53744322 0.46241954
0.82326002 0.66319852 0.40934280
0.04092005 0.90535901 0.47741081
0.06342592 0.79955243 0.38204002
0.81688419 0.76131544 0.36415322
0.79352907 0.86495642 0.45706437
0.97759369 0.74372453 0.72217006
0.95159857 0.78778347 0.58754050
0.97903276 0.02618060 0.66254978
0.01197138 0.98193313 0.79274024
0.92524058 0.03786549 0.98662843
0.91532457 0.96053400 0.86732668
0.07533592 0.79310575 0.95853202
0.09134795 0.87293442 0.07801741
0.90120390 0.06376288 0.58147022
0.87650389 0.04103155 0.48332915
0.97575115 0.03688298 0.51355712
0.81548293 0.96371976 0.64015078
0.82163245 0.86397855 0.61664340
0.77927635 0.92932735 0.54928368
0.65883068 0.06059852 0.73258494
0.88981677 0.19314107 0.72619359
0.98551837 0.28945907 0.66248749
0.70553911 0.26409924 0.57582345
0.79135287 0.14889251 0.53677998
0.73947817 0.04534251 0.45171364
0.07740757 0.15336075 0.50109994
0.02102725 0.99645703 0.09320399
0.59715336 0.94227006 0.24860264
0.42519894 0.37714628 0.95842567
0.09757648 0.30009917 0.55166321
0.12950549 0.03453710 0.58816555
0.32036628 0.14441333 0.81264622
0.56791929 0.17073809 0.53612884
0.35950450 0.99937371 0.53172778
0.75487189 0.51750830 0.24700686
0.83716678 0.76017475 0.81479948
0.59594816 0.69398992 0.93583314
0.59239687 0.62386752 0.19302391
0.76240842 0.88953455 0.20924927
0.97000073 0.20705860 0.20916928
0.73395108 0.16697461 0.33684226
0.20995957 0.38902581 0.08115278
0.75446637 0.29029994 0.03638860
0.45394967 0.68653385 0.80414761
0.61521823 0.47070430 0.81274439
0.36693492 0.32729485 0.71718032
0.22070888 0.20006062 0.39585889
0.31469297 0.45138831 0.42049825
0.19115388 0.78230387 0.67029214
0.53000916 0.13335972 0.97426076
0.66732194 0.97532495 0.83744297
0.63196634 0.95886331 0.10369579
0.38421540 0.78717853 0.02790197
0.43223563 0.75179484 0.40524664
0.20541972 0.84584896 0.29139755
0.16726998 0.65411288 0.98156777
0.43294593 0.60997221 0.56756566
0.76175457 0.39412060 0.77285504
0.52881417 0.30761724 0.66526678
0.59816329 0.53850025 0.46686346
0.46493689 0.48631178 0.13890657
0.32437648 0.61603198 0.32730079
0.96460508 0.69479983 0.34375976
0.00486509 0.83049937 0.83843353
0.66769855 0.88201226 0.46376846
0.54943772 0.94030305 0.70101369
0.75842449 0.16585449 0.68741373
0.99257528 0.42366348 0.54947619
0.73978264 0.39357918 0.46716375
0.09903846 0.16367371 0.55534631
0.47607885 0.06915061 0.51567773
0.60451768 0.62880067 0.05602082
0.85156331 0.21128153 0.28045518
0.55572646 0.59387528 0.80068673
0.25137723 0.33403230 0.39408193
0.66318135 0.98525589 0.97366577
0.31224157 0.80875160 0.36972843
0.64733196 0.32528451 0.73496114
0.37105203 0.54893697 0.21664941
0.59540753 0.89036792 0.58050360
0.87613277 0.41281946 0.47979103
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
81
82
83
84
85
86
87
88
89
90
91
92
93
94
95
96
97
98
99
100
101
102
103
104
105
106
107
108
109
110
111
112
113
114
115
116
117
118
119
120
121
122
123
124
125
126
127
128
129
130
131
132
133
134
135
136
137
138
139
140
141
142
143
144
145
146
147
148
149
150
151
152
153
154
155
156
157
158
159
160
161
162
163
164
165
166
167
168
169
170
171
172
173
174
175
176
177
178
179
180
181
182
183
184
185
186
187
188
189
190
191
192
193
194
195
196
197
198
199
200
201
202
203
204
205
206
207
208
209
210
211
212
213
214
215
216
217
218
219
220
221
222
223
224
225
226
227
228
229
230
231
232
233
234
235
236
237
238
239
240
241
242
243
244
245
246
247
248
249
250
251
252
253
254
255
256
257
258
259
260
261
262
263
264
265
266
267
268
269
270
271
272
273
274
275
276
277
278
279
280
281
282
283
284
285
286
287
288
289
290
291
292
293
294
295
296
297
298
299
300
301
302
303
304
305
306
307
308
309
310
311
312
313
314
315
316
317
318
319
320
321
322
323
324
325
326
327
328
329
330
331
332
333
334
335
336
337
338
339
340
341
342
343
344
345
346
347
348
349
350
351
352
353
354
355
356
357
358
359
360
361
362
363
364
365
366
367
368
369
370
371
372
373
374
375
376
377
378
379
380
381
382
383
384
385
386
387
388
389
390
391
392
393
394
395
396
397
398
399
400
401
402
403
404
405
406
407
408
409
410
411
412
413
414
415
416
417
418
419
420
421
422
423
424
425
426
427
428
429
430
431
432
433
434
435
436
437
438
439
440
441
442
443
444
445
446
447
448
449
450
451
452
453
454
455
456
457
458
459
460
461
462
463
464
465
466
467
468
469
470
471
472
473
474
475
476
477
478
479
480
481
482
2 2 2
0.00000000 0.00000000 0.00000000
0.50000000 0.00000000 0.00000000
0.00000000 0.50000000 0.00000000
0.00000000 0.00000000 0.50000000
0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.00000000
0.50000000 0.00000000 0.00000000
0.00000000 0.50000000 0.00000000
0.00000000 0.00000000 0.50000000
0.50000000 0.50000000 0.00000000
0.00000000 0.50000000 0.50000000
0.50000000 0.00000000 0.50000000
0.50000000 0.50000000 0.50000000
0.12500000
0.12500000
0.12500000
0.12500000
0.12500000
0.12500000
0.12500000
0.12500000
(C129N6O21H85)2 (P1) _ODPABAPP_6_Optica
F
normal
400.00000000
644.87300000
0.00001000
38
10
2997
-1
-1
1514.00000000
0
0
0
0
0.00000000
0
0.05000000
0.50000000
T
T
F
0.00000000 0.00000000 0.00000000 0.00000000
-100
2
F
0
11
1
1
F
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000
1.00000000 1.00000000
-1.00000000
F
0.00000000 0.00000000 1.00000000
F
0.00000000 0.00000000 0.00000000
F
F
F
60
-5
2
400.00000000
T
F
0.00000000
0.00000000
0.30000000
4
0.40000000
0.40000000
1.00000000
0.10000000
1.60000000
1.00000000
4
F
-45
100.00000000
1
1
5
F
F
0
1.00000000
-100.00000000 -100.00000000 -100.00000000
0.00000000
84
84
84
168
168
168
F
0
-1
0
0
0.00000000
0.00010000
0
0.50000000
-3.00000000
1.00000000
0.00010000
0.00010000
1
1
256
10.00000000
2
0.00001000
0
0.77000000 0.32000000 0.73000000 0.75000000
3000
10.00000000
-10.00000000
0.00000000
1
F
F
F
F
F
F
F
T
0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
1
4
-1
T
F
F
F
F
F
3
-1
F
12.01100000 1.00000000 16.00000000 14.00100000
0.00000000 0.00000000 0.00000000 0.00000000
1.00000000 1.00000000 1.00000000 1.00000000
T
T
F
0
F
0
--
1
F
F
F
F
F
F
F
-1.00000000
0
0
0.00000000
0.00000000
0.00000000
1.00000000
1.00000000
1.00000000
1.00000000
1
1
1
F
F
F
0
0
F
0.00000000
0.00000000
0
F
1
F
-0.84910000
0.12340000
1.00000000
0.00000000
0
6.29342967
1.00000000
F
F
F
F
0.10000000
-1.00000000
0.00200000
-0.10000000
0.00000000
0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
F
0.00000000 0.00000000 0.00000000
T
F
F
F
T
0
0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.00000000
F
-1
-1
F
F
F
F
T
0
-1 0 0 0
F
F
F
F
F
F
2
F
F
F
F
F
F
-1.60000002
-1.60000002
-1.00000000
F
-1
0.00000000
0
0
-1
-1
-1
1
1
3
4
0
-30.00000000
-30.00000000
-200.00000000
0
0.10000000
F
F
F
F
F
F
F
1
1
1
2800
0
-1
-1
0.80000001
1.00000000
0.00000000
0.00000000 0.00000000 0.00000000
0.00000000
0.00000000
0.00000000
1
F
F
482
4
ion
element
atomtype
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
H 2
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
O 3
N 4
N 4
N 4
N 4
N 4
N 4
N 4
N 4
N 4
N 4
N 4
N 4
type
atomspertype
element
mass
valence
pseudopotential
258C 12.01100000 4.00000000 PAW_PBE C 08Apr2002
170H 1.00000000 1.00000000 PAW_PBE H 15Jun2001
42O 16.00000000 6.00000000 PAW_PBE O 08Apr2002
12N 14.00100000 5.00000000 PAW_PBE N 08Apr2002
17.16304694 0.00000000 0.00000000
0.00000000 17.16304694 0.00000000
0.00000000 0.00000000 17.16304694
5055.72183101
0.05826471 0.00000000 0.00000000
0.00000000 0.05826471 0.00000000
0.00000000 0.00000000 0.05826471
0.50837469 0.03393992 0.44925660
0.56101576 0.07727653 0.40445413
0.60102449 0.03959159 0.34637540
0.49610952 0.95454220 0.43499785
0.53132797 0.91918964 0.37118679
0.58177373 0.96361851 0.32630388
0.53903416 0.98930093 0.21285914
0.55219945 0.06838267 0.19992310
0.48871054 0.11796700 0.19398094
0.46389197 0.95984705 0.21333033
0.40066244 0.00998103 0.20637480
0.41180336 0.08988885 0.19579370
0.34256897 0.14450263 0.18656455
0.36415814 0.20821049 0.12768549
0.34269210 0.20221306 0.04943396
0.36244883 0.25778198 0.99315386
0.40914115 0.27367441 0.14771887
0.43127713 0.32845813 0.09237049
0.40672634 0.32203937 0.01521204
0.47482258 0.43796590 0.97890328
0.44575864 0.51309257 0.97046471
0.48991043 0.57602817 0.99487645
0.55136594 0.42646857 0.00495566
0.59548610 0.48925194 0.03087743
0.56276966 0.56343905 0.02862296
0.26918971 0.10050588 0.15915857
0.32325343 0.17758709 0.26730796
0.11361700 0.23926841 0.58517972
0.12992805 0.10471553 0.60174888
0.16459127 0.14584318 0.66928745
0.21349086 0.11560016 0.72547044
0.25287808 0.16779554 0.77367982
0.37989850 0.12590919 0.75947463
0.44750969 0.17095429 0.76313710
0.50107088 0.16607529 0.70258576
0.48151446 0.12424418 0.63729741
0.51639108 0.12662319 0.56009763
0.41083171 0.04018520 0.55803980
0.41795221 0.07454456 0.63681100
0.36879424 0.06956791 0.70066085
0.23039785 0.24595522 0.77729381
0.18228116 0.27581765 0.71897225
0.15294993 0.22604957 0.66182641
0.83101677 0.29081475 0.27483107
0.86118477 0.33579414 0.21420560
0.83124765 0.40836687 0.19686883
0.77258880 0.32169220 0.32177422
0.74602524 0.39665747 0.30779162
0.77655538 0.44049188 0.24774957
0.81262813 0.56979235 0.22781400
0.78824339 0.64560564 0.21465117
0.84175799 0.69797603 0.18550502
0.89147809 0.55052907 0.22287117
0.94272428 0.60226134 0.18827058
0.91747880 0.67601898 0.16629879
0.96828519 0.73442826 0.12427410
0.93491314 0.74010989 0.04085747
0.94764843 0.68144900 0.98476246
0.91739033 0.68696812 0.90949956
0.88979511 0.80304560 0.01728797
0.85714309 0.80855633 0.94327318
0.87015355 0.75028508 0.88910815
0.76802107 0.71870574 0.80431304
0.76432451 0.64148325 0.82841618
0.69373671 0.60317751 0.82876797
0.70245678 0.75476377 0.77221082
0.63216787 0.71337685 0.76698221
0.62630385 0.63815242 0.79815465
0.96824683 0.81017181 0.17340232
0.05206841 0.70688589 0.12069804
0.62117198 0.68948063 0.00226260
0.61540952 0.65540166 0.13313697
0.65753064 0.73129104 0.12437799
0.68566184 0.78254462 0.17955942
0.73072241 0.84461207 0.15184292
0.79887187 0.95987117 0.20149901
0.85352688 0.98053601 0.14424464
0.89436562 0.05038246 0.14931995
0.87846760 0.09910887 0.21094237
0.90877422 0.17655987 0.23010978
0.79479732 0.15464493 0.30106319
0.81743504 0.08231815 0.26163870
0.77824376 0.01245656 0.25996921
0.74103502 0.85813142 0.07234970
0.70617411 0.80988534 0.01779486
0.66608074 0.74611254 0.04504384
0.23124441 0.35252117 0.31663105
0.29099366 0.38307369 0.27134427
0.27983611 0.39182084 0.19288655
0.15907016 0.33400991 0.28389330
0.14654633 0.34440042 0.20395362
0.20897179 0.37179439 0.15899503
0.18071130 0.34444917 0.02279759
0.13844896 0.27544156 0.02864588
0.09485803 0.25230322 0.96379894
0.19585543 0.37563656 0.94919166
0.14481151 0.35755594 0.88940248
0.08764610 0.30089653 0.89859926
0.01511853 0.29900741 0.84860398
0.94614037 0.32444319 0.89923701
0.87186371 0.33260376 0.86690805
0.80556530 0.33102955 0.91334099
0.95289204 0.33278772 0.97986344
0.88731944 0.32875449 0.02655978
0.81509756 0.32077349 0.99248732
0.74416008 0.21222360 0.02232386
0.68547121 0.17734270 0.06595930
0.66310015 0.10231120 0.04861062
0.78701458 0.16675704 0.96901134
0.76552597 0.08939340 0.95398358
0.70025231 0.05782252 0.99132118
0.01755756 0.35628216 0.78007996
0.00111609 0.21239194 0.82594254
0.47596621 0.61840363 0.80166734
0.55776103 0.51205031 0.80636675
0.47808972 0.48385267 0.79682774
0.45673962 0.40847162 0.78052830
0.38242348 0.39904791 0.74917051
0.35248230 0.31393340 0.63959965
0.33548105 0.23557108 0.62477029
0.30919060 0.20759551 0.55407351
0.29904748 0.26258830 0.49637090
0.25389968 0.25734667 0.42417643
0.29788227 0.38413955 0.43949716
0.32097906 0.33962168 0.50912933
0.34959719 0.36860490 0.57916106
0.32759987 0.45889931 0.75530891
0.34853952 0.53241210 0.78410957
0.42742139 0.54689158 0.79642264
0.27889288 0.81377524 0.44582884
0.32403211 0.83388962 0.51063895
0.29366381 0.82809412 0.58548587
0.20151753 0.79125700 0.45762000
0.17048733 0.78554955 0.53233300
0.21799298 0.80145314 0.59672281
0.20899644 0.82851161 0.73401238
0.17390853 0.90118924 0.73907806
0.18335447 0.94670160 0.80574137
0.25302088 0.80093902 0.79691849
0.26296781 0.84832502 0.86222252
0.23147120 0.92350833 0.86715954
0.25018035 0.97495898 0.93744732
0.33804215 0.99090416 0.94415195
0.37461590 0.99940690 0.01677456
0.44375124 0.04048711 0.02428601
0.38510159 0.00597392 0.87960335
0.45607644 0.04534764 0.88565795
0.47796185 0.07360060 0.95863945
0.56505533 0.17758228 0.91753586
0.56426965 0.25785955 0.92821731
0.59589210 0.30762494 0.87201840
0.60528244 0.14668292 0.85475964
0.63635406 0.19665547 0.79912716
0.62828134 0.27738869 0.80303318
0.20674524 0.05361174 0.93025283
0.21877162 0.93495515 0.01007526
0.63702883 0.95610502 0.89964085
0.62090243 0.94851987 0.03355777
0.56391674 0.89785521 0.99756832
0.50616706 0.85827581 0.03665845
0.44876424 0.82227067 0.99209054
0.38460685 0.77990774 0.10906802
0.44876656 0.74525321 0.14520951
0.45704699 0.74302199 0.22595929
0.39592621 0.77250836 0.26973150
0.38604401 0.77511927 0.35518023
0.27313171 0.82225555 0.29850950
0.32862625 0.80140946 0.23463600
0.32096286 0.80596932 0.15375057
0.45405579 0.82527768 0.91022163
0.51444125 0.86492506 0.87172897
0.57055895 0.90280446 0.91685451
0.31868825 0.57290802 0.15732049
0.26451124 0.63265347 0.16916836
0.21784004 0.65799291 0.10839346
0.31855118 0.53689967 0.08418456
0.26902930 0.55979500 0.02404397
0.21816499 0.62194783 0.03521211
0.15182354 0.62767734 0.90661675
0.12569646 0.68457995 0.85479486
0.10710865 0.66558938 0.77833742
0.15607341 0.55087592 0.88083320
0.14072080 0.53412487 0.80272362
0.11650722 0.59006499 0.74894129
0.11574935 0.57316060 0.66056564
0.19693649 0.59155774 0.62861692
0.24972307 0.62872413 0.67682561
0.32786256 0.63408516 0.65982495
0.22449516 0.56563204 0.55592971
0.30229221 0.57617677 0.53508762
0.35447320 0.60821757 0.58832625
0.47350478 0.67883652 0.57731855
0.53889129 0.68908787 0.53014081
0.58053471 0.75796088 0.53104224
0.45137401 0.73890130 0.62732265
0.49137564 0.80856625 0.62678911
0.55621360 0.81901718 0.57896515
0.10285917 0.48660835 0.64486805
0.05443610 0.62173243 0.61600313
0.70577317 0.38612152 0.72996498
0.59306164 0.33820932 0.67307766
0.62357468 0.40134636 0.62455025
0.59304530 0.43185901 0.55743189
0.62269604 0.50348664 0.53375811
0.54555937 0.50580878 0.41474567
0.56766407 0.44220423 0.36881019
0.53105240 0.43059784 0.29725427
0.47157982 0.48154321 0.27791866
0.43731845 0.50156825 0.20284225
0.37095791 0.57210166 0.29605027
0.43988904 0.53290656 0.33169788
0.47654484 0.54724483 0.40174079
0.67684084 0.54483125 0.57961655
0.70977446 0.51060367 0.64502569
0.68425567 0.43654699 0.66427477
0.89338356 0.48140257 0.43678314
0.96816333 0.49071545 0.40497915
0.99111354 0.56242126 0.37422521
0.84160567 0.54404124 0.43710248
0.86475979 0.61568777 0.40758248
0.93927124 0.62557055 0.37639317
0.94315599 0.76517140 0.37837622
0.00468825 0.81282325 0.40176421
0.99126606 0.87371973 0.45319402
0.86671881 0.78965413 0.39145522
0.85384516 0.85063161 0.44369783
0.91579604 0.88853063 0.48043176
0.90534901 0.93815815 0.55231330
0.95981548 0.91080642 0.61656440
0.96548290 0.83055309 0.63263835
0.98103956 0.80514918 0.70725530
0.98133140 0.96376464 0.67391098
0.99842400 0.93919572 0.74840419
0.99352005 0.86017680 0.76559786
0.00446092 0.87824024 0.90222188
0.95864479 0.94511049 0.91134788
0.96400195 0.98774248 0.98010367
0.04874034 0.85056565 0.96361187
0.05408704 0.89384755 0.03121492
0.01398882 0.96359472 0.03935562
0.91544094 0.02529727 0.53186031
0.82574644 0.92296969 0.59155804
0.64460090 0.91939962 0.52058510
0.59049369 0.94394295 0.64197993
0.64358923 0.00671938 0.62140286
0.67284271 0.06192671 0.67099034
0.72562541 0.11333834 0.63756521
0.79877954 0.22493866 0.65228652
0.87461854 0.23094547 0.67781139
0.92571087 0.28302130 0.64308768
0.89542110 0.32724183 0.58294194
0.93123575 0.39005660 0.53781880
0.80352389 0.37820664 0.49570285
0.81784821 0.32095929 0.55889429
0.76598251 0.27082486 0.59391387
0.74784734 0.10880286 0.55909774
0.71904021 0.05050801 0.51142891
0.66787961 0.99780259 0.54479618
0.63893300 0.07418499 0.30927156
0.57188326 0.13872115 0.41421335
0.45824560 0.92086239 0.47301661
0.51687626 0.85989787 0.35306074
0.50030074 0.17970656 0.18588237
0.61124126 0.09185974 0.19883758
0.45575708 0.89831532 0.22734348
0.34196382 0.98538668 0.21072251
0.34378045 0.25029468 0.93278442
0.31059455 0.15194998 0.02912741
0.42803674 0.28307318 0.20732570
0.46625404 0.37805525 0.11024722
0.46672140 0.63511229 0.99148975
0.38635371 0.52210061 0.95067360
0.57707735 0.36866632 0.00780144
0.65446454 0.47980951 0.05293382
0.22013131 0.14090142 0.15273084
0.25137291 0.05518469 0.20071163
0.27887814 0.07183045 0.10304462
0.27040645 0.21333561 0.26304672
0.37040321 0.21343125 0.29221850
0.31063298 0.13003865 0.30821463
0.22435817 0.05327064 0.72939534
0.45652415 0.21233150 0.81072001
0.55454410 0.19791291 0.70272962
0.32063869 0.02858160 0.70006309
0.25232522 0.28325073 0.82396211
0.16997723 0.33813970 0.71667932
0.85445947 0.44068427 0.14731428
0.90949229 0.31298582 0.18103868
0.74938108 0.28794468 0.36941010
0.70468775 0.42435972 0.34635292
0.82450938 0.75772804 0.17630502
0.72808852 0.66121201 0.22639472
0.91327115 0.49578647 0.24528514
0.00328872 0.58411600 0.18133747
0.93127213 0.64218648 0.86656737
0.98218052 0.62998273 0.99874814
0.88208490 0.85127647 0.05715303
0.82299870 0.85931807 0.92653007
0.69171493 0.54532405 0.85404869
0.81557982 0.61146052 0.85054579
0.70516098 0.81581900 0.75346591
0.58147657 0.74151809 0.74140361
0.00807450 0.85458855 0.15142134
0.98780585 0.79602853 0.23267419
0.91098387 0.83754682 0.17869286
0.08644418 0.74967224 0.08823990
0.05949378 0.65116579 0.09057598
0.07611244 0.70117868 0.17967609
0.67719453 0.77509284 0.24219918
0.86653685 0.94243444 0.09584048
0.93418500 0.06899396 0.10400541
0.73105605 0.99747886 0.29930819
0.77093873 0.90970870 0.05162303
0.70845195 0.82175320 0.95538345
0.32576588 0.41203120 0.15487409
0.34670821 0.39677727 0.29792336
0.11330964 0.30876822 0.32040025
0.08917223 0.33123362 0.18034288
0.05880960 0.20062346 0.96973584
0.13243996 0.24453783 0.08395772
0.24282663 0.41766561 0.94123801
0.14793037 0.38982382 0.83527026
0.74812317 0.33094635 0.88697268
0.86327314 0.33661333 0.80432499
0.00926769 0.33591590 0.00817830
0.89257252 0.32467163 0.08892326
0.61273018 0.07916636 0.07744596
0.65456577 0.21149759 0.10978629
0.83624186 0.19112228 0.93704898
0.79902704 0.05650941 0.91103287
0.96008491 0.35935024 0.75274423
0.05901298 0.34126430 0.73382242
0.03037793 0.41588239 0.79984522
0.96463984 0.20653644 0.77457361
0.97143150 0.18141148 0.87375341
0.05585607 0.18127231 0.81340537
0.49618869 0.35975345 0.78759340
0.33694562 0.19735968 0.67370263
0.29206073 0.14708264 0.54590198
0.36155117 0.43036898 0.58612267
0.26872077 0.45066028 0.73242774
0.30306539 0.57558529 0.79259390
0.33017364 0.84055147 0.63586493
0.38434087 0.85091808 0.50417032
0.16686688 0.77636543 0.40685862
0.11028028 0.76668001 0.53974476
0.15177695 0.00134616 0.80839897
0.13694011 0.92040769 0.69110893
0.27878991 0.74267716 0.79639651
0.29613552 0.82656444 0.91134403
0.47116405 0.04952056 0.08068441
0.35068883 0.97392308 0.06950836
0.36454328 0.98780667 0.82273261
0.49131987 0.05440227 0.83416716
0.59620896 0.37013190 0.88153196
0.53605985 0.27850026 0.98083502
0.61269087 0.08436210 0.84843113
0.66563082 0.17196754 0.74953858
0.21318828 0.08995212 0.98237033
0.14427621 0.04278357 0.92259445
0.22723879 0.08802745 0.88100046
0.23649747 0.96217760 0.06487042
0.23265450 0.87252122 0.01098480
0.15622365 0.94129870 0.00604353
0.50455971 0.85958037 0.09987170
0.49313178 0.72036430 0.10779535
0.50938208 0.71907127 0.25315896
0.26695837 0.82694582 0.12783013
0.40890474 0.79946613 0.87417467
0.51500148 0.86895724 0.80801553
0.17962718 0.70701003 0.11840612
0.25869605 0.65999385 0.22582440
0.35864139 0.48981136 0.07303510
0.27139582 0.52838813 0.96909674
0.09179041 0.71282162 0.73930476
0.12368774 0.74493877 0.87338078
0.17150344 0.50418000 0.92028648
0.15112942 0.47543661 0.78223032
0.36614070 0.65491478 0.70519926
0.23046220 0.65088894 0.73246886
0.18675178 0.53517909 0.51482212
0.32292736 0.55630447 0.47867223
0.62918715 0.76493734 0.49160907
0.55638370 0.64451579 0.48900902
0.40202810 0.73577781 0.66595831
0.47124838 0.85444504 0.66534562
0.10095983 0.47563353 0.58239424
0.04778565 0.46585992 0.66937167
0.15142098 0.45164595 0.66764873
0.05648614 0.60626680 0.55394164
0.06685619 0.68418780 0.62062810
0.99494199 0.61072797 0.63701865
0.54881806 0.40048005 0.52453209
0.61673886 0.40627964 0.38674355
0.55082181 0.38671740 0.25574397
0.45486050 0.59072202 0.44232655
0.69010534 0.60471879 0.56325645
0.74922287 0.54028541 0.68499523
0.04907844 0.56898272 0.34807017
0.01060511 0.44340850 0.40748585
0.78374544 0.53744322 0.46241954
0.82326002 0.66319852 0.40934280
0.04092005 0.90535901 0.47741081
0.06342592 0.79955243 0.38204002
0.81688419 0.76131544 0.36415322
0.79352907 0.86495642 0.45706437
0.97759369 0.74372453 0.72217006
0.95159857 0.78778347 0.58754050
0.97903276 0.02618060 0.66254978
0.01197138 0.98193313 0.79274024
0.92524058 0.03786549 0.98662843
0.91532457 0.96053400 0.86732668
0.07533592 0.79310575 0.95853202
0.09134795 0.87293442 0.07801741
0.90120390 0.06376288 0.58147022
0.87650389 0.04103155 0.48332915
0.97575115 0.03688298 0.51355712
0.81548293 0.96371976 0.64015078
0.82163245 0.86397855 0.61664340
0.77927635 0.92932735 0.54928368
0.65883068 0.06059852 0.73258494
0.88981677 0.19314107 0.72619359
0.98551837 0.28945907 0.66248749
0.70553911 0.26409924 0.57582345
0.79135287 0.14889251 0.53677998
0.73947817 0.04534251 0.45171364
0.07740757 0.15336075 0.50109994
0.02102725 0.99645703 0.09320399
0.59715336 0.94227006 0.24860264
0.42519894 0.37714628 0.95842567
0.09757648 0.30009917 0.55166321
0.12950549 0.03453710 0.58816555
0.32036628 0.14441333 0.81264622
0.56791929 0.17073809 0.53612884
0.35950450 0.99937371 0.53172778
0.75487189 0.51750830 0.24700686
0.83716678 0.76017475 0.81479948
0.59594816 0.69398992 0.93583314
0.59239687 0.62386752 0.19302391
0.76240842 0.88953455 0.20924927
0.97000073 0.20705860 0.20916928
0.73395108 0.16697461 0.33684226
0.20995957 0.38902581 0.08115278
0.75446637 0.29029994 0.03638860
0.45394967 0.68653385 0.80414761
0.61521823 0.47070430 0.81274439
0.36693492 0.32729485 0.71718032
0.22070888 0.20006062 0.39585889
0.31469297 0.45138831 0.42049825
0.19115388 0.78230387 0.67029214
0.53000916 0.13335972 0.97426076
0.66732194 0.97532495 0.83744297
0.63196634 0.95886331 0.10369579
0.38421540 0.78717853 0.02790197
0.43223563 0.75179484 0.40524664
0.20541972 0.84584896 0.29139755
0.16726998 0.65411288 0.98156777
0.43294593 0.60997221 0.56756566
0.76175457 0.39412060 0.77285504
0.52881417 0.30761724 0.66526678
0.59816329 0.53850025 0.46686346
0.46493689 0.48631178 0.13890657
0.32437648 0.61603198 0.32730079
0.96460508 0.69479983 0.34375976
0.00486509 0.83049937 0.83843353
0.66769855 0.88201226 0.46376846
0.54943772 0.94030305 0.70101369
0.75842449 0.16585449 0.68741373
0.99257528 0.42366348 0.54947619
0.73978264 0.39357918 0.46716375
0.09903846 0.16367371 0.55534631
0.47607885 0.06915061 0.51567773
0.60451768 0.62880067 0.05602082
0.85156331 0.21128153 0.28045518
0.55572646 0.59387528 0.80068673
0.25137723 0.33403230 0.39408193
0.66318135 0.98525589 0.97366577
0.31224157 0.80875160 0.36972843
0.64733196 0.32528451 0.73496114
0.37105203 0.54893697 0.21664941
0.59540753 0.89036792 0.58050360
0.87613277 0.41281946 0.47979103
2079.43386083
-10019.54182818
-49691.27427072
5468.11547778
140596.27938588
-140875.88396789
-0.00000000
-4586.39805902
61408.94557438
4379.67617305
4379.67617305
4379.67617305
-2971.65967848
-2971.65967848
-2971.65967848
-3300.22254187
-3300.22254187
-3300.22254187
-3302.84872722
-3302.84872722
-3302.84872722
-3302.86755568
-3302.86755568
-3302.86755568
-3302.86776625
-3302.86776625
-3302.86776625
2079.43386083
-10019.54182818
-49691.27427072
5468.11547778
140596.27938588
-140875.88396789
-0.00000000
-12268.94200132
61408.94557438
-3302.86776925
-3302.86776925
-3302.86776925