| 320 |
| Lattice="14.680266619594818 0.0 0.0 0.0 14.680266619594818 0.0 0.0 0.0 14.680266619594818" Properties=species:S:1:pos:R:3 pbc="T T T" |
| O 6.89736457 0.51053522 7.66438887 |
| H 5.99185570 0.23162231 7.52839941 |
| H 6.85703945 1.09658584 8.42013380 |
| O 2.49594550 5.75110336 1.84302118 |
| H 2.51791372 6.65708565 2.15115321 |
| H 2.82160106 5.23810699 2.58262582 |
| O 11.11384629 2.90452034 10.53625052 |
| H 11.32924675 3.63925704 9.96179734 |
| H 11.21795079 3.25346580 11.42147997 |
| O 4.07684294 11.21488239 2.04878308 |
| H 3.88531666 11.73194923 2.83120970 |
| H 3.27512171 11.26178756 1.52794259 |
| O 6.11006517 13.07614769 1.40051206 |
| H 5.40605923 12.53234024 1.75389705 |
| H 6.00306078 13.02004812 0.45096757 |
| O 10.62709018 2.97837633 6.96726148 |
| H 10.13843443 3.47838939 6.31347684 |
| H 10.82446365 3.61279867 7.65630710 |
| O 3.97807674 9.98048241 9.38797504 |
| H 3.37277876 9.33374525 9.75071081 |
| H 3.51757688 10.81516502 9.47444279 |
| O 10.30922677 5.63890729 14.32679873 |
| H 11.07958102 5.51727458 13.77182876 |
| H 10.45776465 6.47787619 0.08276545 |
| O 2.58953070 8.44726380 5.65309189 |
| H 2.69576644 9.33536313 5.99401035 |
| H 3.40217413 8.00041581 5.89009268 |
| O 5.81798457 9.22040816 4.26711560 |
| H 5.36482831 8.42920572 4.55845726 |
| H 6.11517301 9.01420227 3.38089328 |
| O 10.21118899 5.61842900 2.39645220 |
| H 11.00701036 5.13175992 2.61105279 |
| H 9.92908010 5.25835831 1.55562194 |
| O 9.13612976 0.35824749 11.53890470 |
| H 9.12395922 0.71611882 12.42660501 |
| H 8.59905142 0.96424045 11.02846249 |
| O 7.81676560 11.72324101 3.22842668 |
| H 7.48644664 11.89139363 2.34590420 |
| H 7.19394534 12.16461596 3.80593419 |
| O 4.91594936 6.72558515 4.45597251 |
| H 4.06846411 6.29794323 4.57894807 |
| H 5.47822286 6.04308564 4.08953729 |
| O 8.49233149 1.97254350 3.97837476 |
| H 8.81498173 1.11183844 4.24542435 |
| H 7.69272770 1.78692858 3.48602047 |
| O 4.19329380 13.82146783 7.48636148 |
| H 3.55842362 13.55013205 8.14934609 |
| H 4.21971919 0.09551735 7.55574639 |
| O 5.47933001 13.97248799 4.63875533 |
| H 5.30632103 13.91544482 5.57846050 |
| H 4.61432768 13.92208210 4.23198503 |
| O 4.91386075 14.33260065 11.33505308 |
| H 4.24639631 13.84632922 10.85104567 |
| H 4.76571914 14.09680909 12.25085233 |
| O 8.06844561 12.48523409 12.07500970 |
| H 7.57455102 12.28157827 11.28076522 |
| H 8.41558920 13.36421700 11.92298264 |
| O 3.34862285 4.02679237 10.62762266 |
| H 2.56508465 3.93034306 11.16891488 |
| H 3.96351773 3.38258885 10.97853287 |
| O 13.69366312 11.16416977 11.98804349 |
| H 13.89883903 10.41529188 11.42829658 |
| H 14.45571909 11.73810184 11.90991205 |
| O 12.86624418 8.96606968 13.63071883 |
| H 13.02440491 9.72840391 13.07388533 |
| H 11.91559412 8.94164860 13.73980556 |
| O 1.32308680 12.62291107 12.46372985 |
| H 1.49241686 12.54408513 11.52492974 |
| H 1.30746858 13.56605591 12.62641279 |
| O 14.44404558 8.90886060 10.52156339 |
| H 13.87367455 8.44550069 9.90820678 |
| H 0.63385331 8.54234035 10.36387578 |
| O 10.80424071 11.07578241 4.41768220 |
| H 10.60298873 10.49407711 3.68464166 |
| H 11.35366032 11.76075543 4.03665477 |
| O 8.45029767 14.21561113 0.31358529 |
| H 8.64698137 0.39686375 14.62597699 |
| H 7.59138939 14.31988894 0.72301729 |
| O 1.07079173 3.53519350 11.77736379 |
| H 0.73584668 4.28885098 11.29152012 |
| H 1.05946771 3.81535012 12.69257737 |
| O 5.44809753 11.24840040 5.83951256 |
| H 6.36608911 11.19838441 6.10601154 |
| H 5.35271725 10.56359488 5.17756402 |
| O 5.70250165 2.49063821 11.12710943 |
| H 5.73943311 1.53523906 11.08149809 |
| H 6.34312692 2.78671340 10.48044831 |
| O 8.30134405 3.81741864 11.95867124 |
| H 7.60763263 4.41986839 11.69024877 |
| H 9.04098644 4.03505436 11.39140087 |
| O 1.32067114 1.54133034 5.63088504 |
| H 1.77078560 0.69680830 5.61060330 |
| H 0.40028293 1.32642419 5.47944947 |
| O 8.22989671 11.23290534 6.38121424 |
| H 8.27603452 10.41474056 6.87589550 |
| H 8.65074559 11.03199418 5.54529990 |
| O 12.36411748 13.40553046 3.95644229 |
| H 12.17648938 13.61722644 4.87088876 |
| H 11.78191492 13.97534412 3.45386449 |
| O 8.80151344 5.30676558 9.19741915 |
| H 9.19572299 6.05394862 9.64747268 |
| H 8.73780478 5.58352783 8.28332084 |
| O 5.27817855 1.46049210 2.48027180 |
| H 5.33906664 0.51953391 2.64495994 |
| H 4.37504699 1.59599409 2.19352374 |
| O 0.49297494 4.28269999 14.43281794 |
| H 1.23057073 4.28081036 0.36261750 |
| H 0.25774018 5.20624036 14.34354508 |
| O 2.20661650 1.52631751 9.45877609 |
| H 2.29813851 1.74493342 10.38617172 |
| H 2.11711592 0.57341733 9.44453702 |
| O 0.33275596 13.94364050 7.90471119 |
| H 14.38228549 13.25062641 7.70943179 |
| H 0.86223303 13.59159959 8.62022016 |
| O 10.18045649 8.38248906 14.11869122 |
| H 9.94152987 8.81140864 0.26011427 |
| H 9.69665372 8.86356776 13.44732692 |
| O 8.34155032 8.92185147 7.82094079 |
| H 7.65181600 9.10376584 8.45922410 |
| H 8.36427197 7.96701099 7.75773286 |
| O 0.28640021 12.93260038 4.00632951 |
| H 14.09455808 13.17803745 3.69743012 |
| H 0.13645954 12.55427515 4.87271260 |
| O 11.46867219 12.92586148 12.40120480 |
| H 12.29121970 12.50366679 12.15341639 |
| H 10.88038084 12.75555328 11.66558244 |
| O 13.27915195 1.37691013 9.26523695 |
| H 13.74619697 0.84003806 8.62502669 |
| H 13.35029146 2.26964577 8.92731078 |
| O 9.88456784 14.14747841 2.73025432 |
| H 9.49402664 13.27388744 2.75366895 |
| H 9.54983356 14.53844678 1.92320503 |
| O 10.96451521 6.67056010 6.66526498 |
| H 11.40930826 7.42289171 6.27489575 |
| H 10.07562652 6.70748555 6.31207203 |
| O 2.54631333 6.37751589 12.78603686 |
| H 3.22926236 5.78985968 13.10925916 |
| H 2.59527565 7.14141872 13.36074289 |
| O 11.79079105 4.97818122 8.60148492 |
| H 11.55017663 5.59868438 7.91350790 |
| H 12.58193835 5.34859856 8.99277612 |
| O 7.53666278 5.53243215 14.10813901 |
| H 8.49160586 5.47408695 14.13832824 |
| H 7.32549128 5.53026984 13.17452572 |
| O 14.44590076 11.43819736 6.21127807 |
| H 13.93582116 10.62838523 6.19531019 |
| H 0.60455132 11.18584529 6.59698293 |
| O 6.19708187 11.66774595 10.28335823 |
| H 6.08870151 10.79289078 10.65633809 |
| H 5.41526757 11.79841112 9.74677192 |
| O 0.03724765 10.32762858 3.10227455 |
| H 0.42487335 11.11237618 3.48976567 |
| H 14.45392741 10.59922960 2.22307793 |
| O 12.21687958 13.73534160 0.36101460 |
| H 11.69936251 14.33270657 0.90098036 |
| H 11.67795362 13.58612547 14.26441238 |
| O 1.31746055 0.66972456 12.73421518 |
| H 2.11462066 1.19939339 12.74899782 |
| H 0.60465047 1.30841191 12.74877922 |
| O 7.31525234 2.99744499 8.92750466 |
| H 6.90279364 3.32302835 8.12743894 |
| H 8.11536250 3.51583564 9.01310094 |
| O 13.07719096 8.91712469 5.37777628 |
| H 12.16950122 8.90216596 5.07428423 |
| H 13.58833664 9.12519888 4.59568481 |
| O 4.08579857 1.81685361 7.54553683 |
| H 3.69925233 2.03638994 6.69782363 |
| H 3.37409210 1.94158053 8.17334966 |
| O 13.30415930 5.51886833 2.42564502 |
| H 13.61980073 6.20476636 1.83730308 |
| H 13.89955600 5.55221433 3.17439242 |
| O 2.47667070 5.27951667 4.72719488 |
| H 1.60058702 5.66469713 4.70861374 |
| H 2.39966783 4.53688685 5.32619685 |
| O 9.47115389 4.36630633 4.90825084 |
| H 9.78330511 4.96309152 4.22807372 |
| H 9.09644595 3.62869591 4.42683970 |
| O 3.64606976 2.31743989 13.18871263 |
| H 4.52353410 1.94789582 13.09009531 |
| H 3.77385331 3.09899435 13.72637036 |
| O 7.19618440 5.17830034 2.07556842 |
| H 7.33841795 5.28359330 1.13486929 |
| H 8.07662820 5.11569547 2.44588073 |
| O 7.94442204 6.16997313 6.53641212 |
| H 8.16332293 5.40682993 6.00169098 |
| H 6.98890646 6.15802418 6.59190129 |
| O 14.25782693 6.32772544 11.94881316 |
| H 13.98267583 7.24175208 12.02008046 |
| H 0.13825628 6.30565452 11.17333605 |
| O 8.34072789 12.42224483 8.92163012 |
| H 8.16058147 12.22922636 8.00156328 |
| H 7.51604553 12.23823570 9.37137616 |
| O 14.40341308 7.05105686 0.48649037 |
| H 0.60165840 7.22614375 0.14915787 |
| H 13.83739090 7.65646994 0.00761069 |
| O 2.63120272 7.75363801 10.31785204 |
| H 2.57259495 7.11647020 11.02976086 |
| H 2.66358615 7.22232390 9.52230915 |
| O 2.72616957 8.72069836 14.55918125 |
| H 2.22344316 9.53217497 14.62991819 |
| H 2.86443663 8.44430309 0.78485046 |
| O 0.72474149 5.70636903 9.46845922 |
| H 0.45867035 4.85979213 9.10964792 |
| H 0.46653931 6.34183726 8.80081889 |
| O 10.02286935 7.37103213 10.47514682 |
| H 9.78891772 8.25116183 10.76988431 |
| H 10.56474564 7.01778962 11.18071160 |
| O 12.95319110 1.41892373 6.09086449 |
| H 12.38498263 2.08426243 6.47905953 |
| H 12.52687164 0.58773603 6.29969596 |
| O 9.10879160 2.07102700 14.15215487 |
| H 9.67105010 2.38581553 0.17970561 |
| H 8.86153047 2.86157839 13.67244423 |
| O 13.67007454 11.03245334 0.63813607 |
| H 13.11610410 11.68874080 1.06078885 |
| H 13.20764142 10.81298974 14.50956205 |
| O 12.79365063 3.05332204 0.00162813 |
| H 13.73695319 3.21097139 14.64241297 |
| H 12.61278668 2.91109268 0.93076262 |
| O 9.49080907 0.92541633 8.58401333 |
| H 9.88543937 1.59324167 8.02320312 |
| H 8.84194970 0.49642104 8.02618145 |
| O 4.46193803 10.26826583 12.94916912 |
| H 3.85749070 10.89402762 12.55004827 |
| H 3.91797470 9.75888111 13.54988783 |
| O 14.61094893 0.21921096 0.47287497 |
| H 13.79862043 14.41059347 0.34116854 |
| H 0.29623766 0.31850276 14.27408398 |
| O 9.53323425 9.76438485 2.16904039 |
| H 8.90052062 10.15045793 2.77472420 |
| H 9.29229002 10.11787501 1.31275630 |
| O 10.43926930 2.41547490 2.04560999 |
| H 11.34513030 2.18715493 2.25421895 |
| H 9.94485499 2.17625739 2.82954961 |
| O 8.82451343 13.82707676 5.62593566 |
| H 7.98421462 14.27680814 5.71465683 |
| H 8.62821901 12.91090472 5.82171393 |
| O 11.40468702 13.88284444 6.78439912 |
| H 11.41736032 13.54180651 7.67869458 |
| H 10.48968916 13.81029971 6.51283323 |
| O 12.20359964 4.85476989 12.55437598 |
| H 12.95631094 5.39769049 12.32007964 |
| H 12.52523633 4.28846104 13.25585726 |
| O 5.80164199 4.04736387 6.62975727 |
| H 5.47944069 3.17684213 6.86344529 |
| H 5.66212498 4.10921575 5.68480161 |
| O 10.37626653 7.93203042 4.09945364 |
| H 10.79341439 7.22248191 3.61082247 |
| H 9.95681776 8.47102874 3.42880068 |
| O 5.69578764 7.86486639 8.80181910 |
| H 5.09835917 7.17200150 8.52030655 |
| H 5.12828669 8.61676604 8.97158787 |
| O 2.59766227 0.48870837 1.20444850 |
| H 2.89774500 0.68281212 0.31646993 |
| H 1.64379752 0.45307350 1.13300586 |
| O 6.48265112 9.07212427 11.24136367 |
| H 6.27027977 8.54783685 10.46918949 |
| H 5.75511305 8.91757356 11.84388694 |
| O 5.54382441 3.93901536 3.58974285 |
| H 6.18813550 4.41872530 3.06919175 |
| H 5.49097001 3.07891973 3.17300099 |
| O 5.68811324 12.53386162 13.40248065 |
| H 5.32725692 11.65129911 13.31823117 |
| H 6.54505517 12.48419800 12.97890551 |
| O 4.36920049 4.62485139 14.43302671 |
| H 5.31198066 4.47248137 14.49768573 |
| H 4.14673589 5.09658197 0.55538803 |
| O 10.75128991 13.02072369 9.61894543 |
| H 10.90544113 12.34681601 8.95688978 |
| H 9.79897961 13.05500922 9.70928618 |
| O 12.79415878 1.59231901 3.19169769 |
| H 13.55081335 1.01324412 3.10016635 |
| H 12.59272226 1.57791015 4.12735123 |
| O 6.49482468 5.88182546 11.34987087 |
| H 6.38437819 6.26667259 10.48043076 |
| H 5.86949949 5.15748434 11.37289724 |
| O 12.21355577 0.88160594 12.58479008 |
| H 11.89325367 0.02984050 12.88166387 |
| H 12.16894128 1.43888181 13.36176177 |
| O 9.05014550 9.77698250 12.22139367 |
| H 8.19393016 9.60326481 11.83030635 |
| H 8.99349858 10.68085358 12.53129695 |
| O 0.36207578 7.36499509 6.77402885 |
| H 1.18854144 7.76792672 6.50788517 |
| H 14.38028541 7.79565321 6.23324611 |
| O 2.94831837 10.98730500 6.78201242 |
| H 3.79749325 11.30874153 6.47900677 |
| H 2.84522715 11.36740267 7.65443996 |
| O 14.36320530 5.01661294 5.26268432 |
| H 14.51076249 5.76279723 5.84377617 |
| H 14.12863753 4.29792887 5.84979847 |
| O 6.39839900 9.94473832 1.08805493 |
| H 5.56120362 10.16512338 1.49642507 |
| H 6.34360439 10.32154795 0.20985000 |
| O 12.50413605 7.73154083 9.12042198 |
| H 11.65156445 7.67780640 9.55223923 |
| H 12.35605351 8.30339315 8.36723651 |
| O 3.89755700 5.68365179 8.29492016 |
| H 4.48127123 5.13197227 7.77419061 |
| H 3.44262089 5.07212578 8.87397191 |
| O 1.98448108 8.33048671 2.60745692 |
| H 1.20337069 8.88149535 2.65733562 |
| H 2.45298366 8.50382338 3.42396876 |
| O 1.66035885 11.02154164 0.16186194 |
| H 0.76585985 10.96841715 0.49843465 |
| H 1.61852577 11.68465863 14.15310192 |
| O 2.99857650 13.83639476 3.50937858 |
| H 2.16382404 13.41716536 3.71834482 |
| H 2.80204314 14.40430315 2.76433727 |
| O 9.90534864 11.64360400 14.45986227 |
| H 9.40813508 12.43130799 14.68016424 |
| H 10.19414007 11.78635699 13.55850055 |
| O 0.49051091 3.16998675 7.81116550 |
| H 0.87912439 2.61530668 8.48758360 |
| H 0.63552478 2.69082248 6.99531966 |
| O 10.97291150 11.14341658 7.77542736 |
| H 11.21383350 11.12804236 6.84917034 |
| H 10.06812533 10.83152648 7.79327106 |
| Na 11.29867163 0.54975764 10.36191238 |
| Cl 2.52119593 12.71969190 9.77870964 |
|
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