Optical_PMDABAPP_2_3chains_geomfrom958
1
16.322586 0.000000 0.000000
0.000000 16.322586 0.000000
0.000000 0.000000 16.322586
C H N O
222 150 12 36
Direct configuration= 1
0.07308875 0.33521843 0.00610856
0.10108941 0.25432423 0.01204498
0.04837809 0.18798164 0.01108454
0.99587913 0.35470461 0.97754581
0.94748467 0.28632929 0.96328767
0.96822894 0.20736743 0.99116228
0.14408727 0.38991595 0.01396087
0.18864219 0.25591233 0.99224182
0.89580448 0.15323779 0.97581827
0.87831271 0.27793074 0.90767416
0.76862590 0.17513276 0.88912086
0.74699104 0.09324327 0.87914912
0.67023468 0.07425936 0.84745098
0.71465996 0.23724357 0.86507286
0.64069340 0.21750212 0.83024494
0.61773339 0.13650489 0.82152685
0.51483873 0.04927151 0.77122614
0.48855099 0.00447587 0.83895449
0.46172951 0.92442248 0.82731010
0.50953641 0.01778637 0.69271637
0.47926572 0.93854569 0.68218260
0.45922422 0.88845662 0.74879264
0.43418684 0.79834880 0.74121751
0.43345507 0.76961503 0.65347667
0.37017193 0.72084235 0.62304516
0.35825745 0.71539214 0.53941773
0.49950268 0.78575553 0.60080781
0.49197991 0.77482064 0.51676528
0.41638226 0.75002121 0.48766855
0.37735412 0.67682503 0.37763444
0.41824381 0.60876490 0.41263701
0.38496731 0.53378438 0.40152517
0.30958158 0.66888082 0.32495383
0.28349764 0.59199934 0.30546422
0.31949421 0.51837624 0.34249077
0.49868946 0.74291495 0.77889514
0.35251865 0.78708187 0.78801850
0.19763518 0.25914941 0.60669282
0.12618314 0.30084810 0.58390115
0.05967086 0.25891345 0.54982181
0.21345273 0.17904547 0.58588201
0.15127979 0.13976684 0.54483720
0.07390622 0.17580277 0.53536953
0.24921953 0.31095841 0.65852820
0.13820560 0.38611090 0.61175150
0.01656679 0.10749709 0.52366007
0.14507523 0.05579552 0.51316424
0.03192825 0.95399250 0.51775741
0.94952430 0.93695376 0.50015750
0.92894477 0.86090106 0.46888890
0.08771793 0.88893219 0.52455153
0.06761672 0.81281235 0.49213528
0.99119349 0.80405102 0.45480650
0.92733875 0.73636451 0.34180206
0.89526948 0.80599931 0.30432362
0.82549427 0.79672767 0.25611586
0.90685932 0.65879945 0.31267026
0.83699508 0.65078177 0.26586044
0.78809974 0.71991774 0.24964477
0.70295530 0.70418689 0.21560899
0.65278923 0.63317830 0.25273196
0.58005092 0.61711751 0.21365293
0.52066837 0.55474922 0.24258503
0.67186054 0.58370925 0.32187545
0.61843800 0.52369640 0.35273491
0.54465233 0.50932223 0.31562981
0.43122456 0.41587599 0.28259374
0.35012436 0.46198296 0.27135251
0.28452019 0.40983260 0.23470214
0.41830411 0.32792364 0.30892061
0.35201689 0.28706202 0.27991513
0.28549095 0.32713719 0.23606064
0.64451069 0.77853755 0.20458765
0.73081937 0.68305631 0.12954021
0.95108231 0.37239290 0.70001092
0.01669800 0.33563765 0.74185094
0.08095596 0.38097569 0.77502739
0.94087238 0.45533292 0.69171344
0.00151651 0.49889959 0.73023665
0.07260418 0.46517720 0.76513213
0.89377649 0.31014698 0.67254327
0.00265082 0.24631682 0.74004960
0.13249773 0.53416756 0.76786435
0.00415072 0.58649921 0.74058055
0.11354704 0.68582903 0.73745300
0.17821481 0.69646442 0.68350028
0.20454297 0.77507606 0.66577231
0.07027817 0.75384494 0.76695015
0.09762153 0.83271625 0.75021859
0.16827947 0.84254613 0.70272326
0.26615275 0.94358423 0.65020450
0.29052337 0.90950645 0.57520170
0.33719275 0.95607732 0.52110851
0.30446060 0.01536114 0.67653948
0.35196861 0.05946043 0.62183134
0.36068198 0.03605671 0.53952351
0.39048348 0.09621919 0.47395255
0.47057470 0.13071915 0.50390383
0.54223922 0.10379390 0.46772662
0.61704769 0.13562861 0.49035004
0.47584248 0.18869332 0.56735904
0.55104357 0.21853361 0.59362931
0.62197522 0.19436265 0.55232440
0.74957454 0.22564732 0.50569399
0.78868018 0.15157357 0.49041326
0.82284153 0.13590997 0.41383540
0.75111136 0.28843226 0.44821383
0.78493271 0.27136874 0.37228464
0.81928365 0.19560308 0.35322464
0.39592241 0.05513199 0.38989452
0.33456900 0.17047522 0.45861855
0.21195902 0.02145918 0.24581805
0.14285386 0.06855141 0.26673955
0.13887312 0.15242912 0.25073774
0.27678012 0.05651110 0.20288506
0.27391075 0.14010533 0.18290616
0.20791427 0.18914588 0.21220178
0.19828741 0.93682433 0.27802347
0.08243002 0.01481514 0.31009067
0.21013888 0.28125467 0.20543909
0.33889033 0.17435033 0.12478294
0.34709460 0.28966222 0.03089533
0.29565050 0.36497686 0.00924549
0.32038645 0.41787372 0.93809187
0.41172531 0.27242071 0.97551160
0.43441722 0.33115669 0.91753726
0.39740780 0.41118895 0.90626485
0.48562196 0.54543754 0.87297907
0.48628741 0.61187774 0.92975906
0.55316990 0.66518801 0.93800330
0.54795000 0.55326155 0.81572476
0.61525965 0.60569967 0.82497521
0.62264213 0.66353993 0.88819808
0.69584876 0.72270493 0.90364713
0.70851835 0.79646838 0.85041700
0.79339843 0.81751596 0.82489622
0.80176359 0.89274797 0.77711907
0.64477713 0.84700151 0.82925540
0.65642419 0.90307583 0.76633872
0.73436446 0.91799263 0.73424830
0.79143723 0.02453811 0.66734580
0.75057718 0.09753823 0.68034592
0.79558795 0.16722629 0.69522011
0.87662994 0.01767954 0.66913948
0.92207702 0.08777592 0.68550115
0.88104125 0.16198859 0.69583998
0.68720046 0.77226525 0.98324961
0.77267662 0.66974140 0.91068795
0.42755124 0.54529447 0.12721754
0.42510836 0.51431247 0.04915508
0.35940864 0.54305892 0.99904665
0.37666184 0.61058273 0.15494580
0.30402163 0.62306423 0.11162903
0.29679617 0.58616544 0.03451352
0.49318751 0.49737055 0.17301923
0.50241333 0.46456685 0.03871297
0.22047907 0.61457931 0.99511542
0.22742049 0.67145712 0.12569686
0.10370615 0.70140582 0.03818237
0.09560497 0.75125054 0.96816895
0.02274213 0.79103360 0.95212115
0.03639079 0.69277085 0.09145596
0.96237001 0.73092997 0.07433286
0.95179324 0.78081248 0.00242303
0.80995613 0.75921307 0.75133079
0.87164321 0.76494771 0.69161453
0.86430713 0.71993513 0.61944541
0.74505436 0.70675219 0.73566953
0.74141477 0.65745430 0.66841056
0.79682210 0.66826063 0.60597899
0.76485757 0.64926309 0.52212255
0.73737737 0.73474945 0.49226795
0.73677404 0.75140895 0.40930609
0.70166173 0.82219542 0.37823000
0.70612277 0.79603035 0.54464481
0.66928798 0.86692837 0.51405293
0.66489358 0.87851375 0.42965959
0.57598011 0.93230781 0.32943348
0.59508909 0.96170984 0.25156433
0.53998376 0.94827073 0.18709892
0.50214630 0.89166404 0.34336835
0.44764832 0.87812871 0.27904947
0.46676815 0.90586222 0.20041894
0.83105755 0.60353424 0.47438798
0.68723379 0.59572604 0.52003004
0.83925644 0.50275167 0.91523454
0.77234006 0.48924181 0.96733438
0.69785214 0.46528028 0.93582272
0.83339744 0.49853285 0.83044084
0.75891898 0.47075492 0.79794492
0.69594976 0.45050444 0.85220775
0.90666900 0.53947295 0.96419606
0.79460350 0.51754675 0.05086387
0.62838763 0.41652282 0.80522456
0.72508301 0.46049095 0.71241779
0.57858221 0.41923626 0.66300339
0.49635364 0.41889115 0.68981725
0.43104729 0.41118916 0.63602631
0.59203907 0.40939505 0.57917235
0.52654648 0.39693984 0.52511661
0.44512673 0.39745089 0.55341460
0.30379690 0.40665086 0.49914577
0.28485903 0.48685741 0.52473661
0.21191333 0.52332487 0.49895989
0.24596107 0.36344612 0.45301032
0.17381345 0.40236407 0.42678417
0.15687731 0.48446263 0.44524452
0.08439513 0.53343892 0.41055414
0.03064174 0.48306799 0.35132705
0.02088649 0.49770358 0.26690972
0.96400572 0.45457833 0.21836205
0.98488843 0.41731538 0.38225963
0.93129645 0.37113438 0.33421903
0.91576417 0.39247023 0.25239050
0.78184977 0.36560663 0.18253998
0.72513908 0.39700369 0.23806846
0.64429308 0.41117774 0.21496969
0.74949425 0.34396843 0.10533772
0.67034572 0.36775141 0.08048646
0.61831949 0.41311307 0.13320018
0.03034878 0.56013646 0.48333859
0.11402628 0.61264004 0.36875070
0.06933066 0.12576440 0.02120619
0.97986884 0.41656217 0.95860291
0.65441347 0.01050082 0.84011914
0.79061954 0.04499200 0.89332990
0.73316230 0.30077965 0.86945967
0.59916297 0.26375668 0.80751567
0.44127768 0.88963585 0.88080473
0.49056706 0.03251922 0.89967827
0.52989019 0.05384788 0.64018628
0.47183129 0.91689466 0.61957814
0.30336996 0.68772048 0.51316775
0.32703257 0.69129557 0.66419815
0.55710844 0.81013255 0.62419796
0.54323274 0.78709857 0.47607504
0.41240485 0.48070877 0.42888190
0.46711027 0.61699515 0.45768677
0.27881601 0.72275823 0.30045416
0.23391717 0.58264451 0.26208121
0.48341605 0.67882484 0.76634852
0.50160329 0.75116922 0.84502143
0.55903501 0.75448607 0.75206726
0.32022247 0.73009082 0.77283325
0.31154788 0.83876229 0.77563467
0.36349754 0.78502305 0.85456220
0.00009751 0.28605726 0.53826321
0.26872003 0.14810595 0.60459891
0.86588108 0.84874170 0.45099871
0.90380232 0.98461714 0.50725163
0.14827298 0.89853918 0.55079500
0.11024324 0.76129920 0.49298306
0.79609858 0.85178718 0.23203224
0.91887753 0.86704068 0.31723089
0.94091849 0.60499951 0.33199784
0.81512133 0.58995722 0.24767887
0.46249868 0.58737493 0.25734292
0.56109461 0.64870676 0.15728316
0.73095537 0.58900490 0.35075360
0.63493009 0.48269064 0.40294223
0.23031889 0.44183296 0.21272572
0.36541544 0.50912397 0.22643182
0.46242382 0.30073215 0.35063885
0.34377298 0.22219019 0.29191210
0.60654568 0.77105936 0.14903216
0.67814774 0.83648454 0.19559324
0.60132810 0.78635790 0.25548817
0.68088374 0.65421344 0.09513867
0.78161047 0.64085883 0.13149484
0.75313418 0.74008179 0.10273026
0.27271152 0.48349814 0.37506103
0.22746240 0.43811447 0.69133526
0.13385946 0.35207093 0.80330894
0.88836001 0.48282387 0.66088188
0.25887011 0.78310936 0.62963089
0.20922677 0.64297916 0.65824625
0.01709941 0.74407598 0.80554498
0.06737359 0.88602929 0.77708611
0.34766660 0.93074553 0.46041990
0.26827365 0.85176272 0.55163592
0.29458012 0.03780533 0.73865684
0.38048913 0.11502477 0.64488787
0.67020201 0.11599149 0.45609593
0.54081554 0.05918665 0.41863310
0.42135263 0.21387898 0.59666125
0.55340231 0.26355784 0.64265941
0.85209147 0.07710596 0.40164207
0.78714648 0.10358226 0.53642175
0.72291073 0.34744105 0.46192471
0.78531485 0.31828396 0.32586478
0.41953365 0.09884318 0.34424047
0.33431773 0.03543157 0.37087467
0.43563358 0.00137095 0.38895433
0.36712521 0.21104744 0.41621268
0.32451619 0.20769628 0.51314492
0.27551041 0.15166861 0.43212488
0.08374573 0.18810819 0.26544690
0.32989171 0.02147969 0.18150381
0.27495611 0.45979955 0.91273719
0.29890536 0.40543948 0.06436539
0.44533127 0.21468357 0.97873760
0.48194409 0.31577243 0.87425859
0.54822309 0.71272499 0.98479500
0.43571911 0.63022299 0.96801004
0.54097888 0.52141889 0.75809721
0.66400243 0.59513775 0.78104815
0.86280921 0.91739426 0.76782607
0.83779101 0.81290471 0.87710849
0.58461608 0.83820639 0.85598659
0.60588651 0.93820481 0.74164305
0.76402207 0.22457378 0.70448614
0.68392974 0.09761982 0.67751931
0.90713514 0.95949126 0.65697886
0.98861358 0.08630244 0.68818108
0.74873333 0.79680563 0.99787057
0.67006753 0.72796132 0.02928721
0.64164836 0.82156073 0.98182104
0.82992186 0.70449788 0.91255437
0.77624621 0.62633957 0.86008536
0.76774870 0.63718883 0.96883793
0.84483020 0.18537252 0.29249152
0.09933236 0.89114373 0.35024204
0.35726396 0.54504890 0.93333108
0.39585326 0.65321486 0.20280434
0.01766137 0.83330859 0.90071724
0.14741496 0.75948808 0.92661594
0.04237143 0.65567734 0.14685527
0.91056170 0.72478374 0.11613852
0.90967179 0.72891595 0.57111480
0.92486463 0.80433022 0.69887751
0.69067060 0.70665529 0.77255370
0.68813568 0.61861933 0.66147137
0.70349410 0.83687369 0.31388603
0.76758509 0.70903627 0.36860473
0.71006134 0.78993683 0.61097873
0.64364120 0.91215767 0.55577458
0.55425528 0.97164109 0.12614211
0.65326680 0.99303731 0.24153637
0.48638594 0.87437895 0.40566376
0.38850275 0.84995179 0.29142085
0.81305826 0.58477802 0.41279237
0.84669393 0.54720834 0.50827770
0.88581907 0.64137038 0.46852348
0.66443902 0.59732176 0.45749923
0.63736083 0.61986626 0.55799705
0.70047146 0.53219674 0.53771707
0.64126238 0.46170968 0.97038942
0.88370827 0.52032382 0.79421707
0.36941834 0.41022993 0.66144630
0.47951278 0.42315775 0.75365592
0.65446149 0.40783432 0.55640802
0.53958153 0.38438057 0.46099832
0.20348377 0.58849405 0.51145064
0.32880117 0.52099710 0.56146931
0.25908654 0.30127179 0.43249815
0.13007267 0.36700875 0.39071433
0.96103194 0.46580572 0.15242640
0.05629563 0.54552484 0.23632143
0.99044051 0.40108192 0.44698261
0.90479805 0.31729596 0.36274134
0.60027421 0.41815240 0.26381801
0.74100279 0.41253392 0.30072994
0.78885007 0.31487458 0.06021033
0.65235513 0.35340615 0.01825791
0.98280730 0.60139049 0.46138297
0.06696922 0.59255952 0.52954138
0.00270242 0.50797674 0.51473097
0.06473253 0.65755784 0.36276140
0.13776964 0.60217542 0.30720003
0.16277999 0.64234576 0.40432331
0.42347378 0.89531996 0.15037116
0.90496563 0.57671072 0.08970784
0.21165601 0.33853857 0.00248681
0.84455737 0.19944509 0.92187656
0.21017616 0.38660949 0.65881492
0.06166862 0.03385957 0.52685212
0.92459194 0.23542755 0.70388690
0.08648638 0.60617195 0.75643118
0.12000559 0.93805349 0.31392258
0.31695279 0.25017030 0.09509119
0.54807428 0.46499297 0.11164061
0.18011518 0.66289144 0.05384785
0.87479714 0.54639456 0.04384313
0.64364808 0.42930526 0.72149755
0.22934030 0.20106538 0.96069052
0.14554040 0.46296018 0.02959482
0.85750953 0.32801651 0.85582738
0.88235905 0.08402475 0.00009012
0.54477485 0.12713645 0.78067479
0.39815716 0.75280922 0.40445437
0.09614118 0.44725818 0.59977321
0.31140277 0.29096960 0.69593023
0.19436815 0.01747464 0.47270404
0.94089257 0.11206018 0.51973033
0.98089354 0.73595668 0.40688747
0.49398623 0.44879963 0.34045008
0.04869949 0.19148456 0.76283203
0.83337712 0.32043852 0.63009705
0.94639659 0.63343739 0.73937294
0.20758296 0.52877251 0.76787560
0.20164062 0.91969168 0.70044502
0.69484697 0.23371561 0.57118248
0.01488023 0.03180859 0.33815255
0.24368486 0.87727351 0.27671054
0.40034796 0.13377420 0.10630471
0.14730862 0.31859409 0.18634119
0.42707588 0.47826628 0.85587291
0.73996488 0.95694189 0.66012573
0.52943314 0.43037213 0.97715915
0.46556663 0.41680234 0.20442624
0.20374040 0.70918277 0.18635307
0.19563150 0.60139672 0.92566189
0.88334657 0.81584868 0.98354040
0.62814773 0.94761172 0.39577284
0.75320419 0.52043949 0.11272058
0.97512490 0.55842239 0.94309865
0.75711947 0.47582705 0.64641535
0.57162889 0.37497532 0.83232351
0.38212283 0.37325961 0.50109383
0.86318488 0.34652758 0.20109627