SCSD model generated from precomputed using C2v symmetry, available as bodipy

Table 1; Model atom positions

xyzat
0.00.0-1.2741B
2.554-0.01.497C
3.3646-0.00.3858C
2.51620.0-0.7301C
-2.51620.0-0.7301C
-3.3646-0.00.3858C
-2.554-0.01.497C
-0.0-0.01.7428C
1.2126-0.01.04C
-1.2126-0.01.04C
0.01.1244-2.0829F
0.0-1.1244-2.0829F
1.23150.0-0.3442N
-1.23150.0-0.3442N

Figure 2; Model atom positions and symmetry operations



ACESEJ, ACESIN, ACESOT, ACESUZ, ADOPOA, ADOPUG, ADOSEU, ADOSIY, ADOSOE, AFIKEH, AFIKEH01, AGIFEE, AGIFII, AGIFOO, AGIWUL, AHIFOO, AHILEK, AKEJOR, AKIKOU, AMOSEB, AMOSIF, AMOSOL, AMOSUR, APUNEG, APUNIK, AQEQIY, ASECOS, ASETOI, ASETOI01, ASETOI02, ASETOI03, ASOGEU, AYOWUH, AZEWEJ, AZEWUZ, AZEXAG, BAMRIT, BAMROZ, BAMRUF, BAMSAM, BAMSEQ, BAMSIU, BAMTAN, BAMTER, BAQZAW, BAQZOK, BAVKER, BAVKIV, BAWHIS, BAWHUE, BAZSAZ, BEHZEV, BEHZEV01, BEKQOA, BELYEZ, BELYID, BELYOJ, BERQUN, BESGUE, BEXVUX, BEXWAE, BIBQEK, BIBQIO, BIBQOU, BIBQUA, BIBRAH, BICKAB, BICROW, BICSAJ, BIDHOO, BIDHUU, BIGWOF, BILQAQ, BILXOL, BINSUP, BINTAW, BITSEE, BOHKAN, BOJFUD, BOJGAK, BOJGEO, BOJGIS, BOMMUN, BONBIR, BONBIR01, BONBOX, BONCAK, BUVMUC, CADXOW, CAHFIC, CAHZAO, CAHZES, CAJNUY, CALMIO, CALMOU, CAPWOI, CAQZIG, CAQZOM, CEVTIJ, CEVTOP, CEVTUV, CIMMUI, CIMMUI01, CIMMUI02, CIMMUI03, CIMMUI04, CIMMUI05, CIVXUD, CIVYAK, CIVZEP, CIXDEU, COCGIM, COCGOS, COCGUY, COCHAF, COCHEJ, COCHEJ01, COCHEJ02, COCHEJ03, COCHEJ04, COCKUC, COKQOL, COKQUR, COKYIN, COLHIW, COLXOS, COLXUY, COLYAF, COLYEJ, COSYIU, CUBXAA, CUCKAO, CUHLIB, DACDOD, DACDUJ, DACQIJ, DACZIS, DAFLAZ, DAFLAZ01, DAFLED, DANCAY, DASHOX, DELBUU, DELCAB, DELCEF, DESTAZ, DESTED, DETZUA, DEXBIU, DEXFIY, DEXGAR, DICJOP, DITREF, DITRIJ, DIYLAB, DIYLEF, DIYQEK, DIYQIO, DOGVED, DOHXOQ, DOJMAT, DOJXAD, DOKLUM, DUBPIB, DUBPOH, DUHGUK, DUMSOV, DURYOG, DUVBAZ, DUWGOS, DUYQUL, DUYRAS, DUYREW, EBABUF, EBACAM, EDIFOP, EDIGAC, EDIGEG, EDOSUO, EFEJOP, EFEVER, EFEVIV, EGAFEA, EGAFIE, EGAGID, EGAGOJ, EGAGUP, EGAGUP01, EGAHAW, EGAHAY, EGIYAV, EJEHUY, EJEJAG, EKUJEA, EKUJIE, EMUYUI, ENOXIQ, ENOXOW, ENOXUC, EPOHIC, EPOHOI, EQIJUK, EQIKAR, EQIKEV, EQIKIZ, EQIKIZ01, EQOREI, EQOROS, EQOROS01, EQORUY, EQOSAF, EQOSEJ, EQOSIN, ESOPOT, ESOQAG, ESOQEK, ESOQOU, ESOQUA, EVIFOG, EVIGAT, EYOLEK, EZUJOA, EZUJUG, FACHOJ, FACVAJ, FAFYIW, FAFYOC, FALTOE, FASSIE, FAWJAR, FENWEC, FEZGAV, FIDKEK, FIDLEL, FIDLIP, FIDLOV, FIDLUB, FIDMAI, FIFKAJ, FIFKEN, FIFKIR, FIFKOX, FIFKUD, FIHHUB, FINDEO, FINDIS, FIQPEC, FITBUI, FITCAP, FITCET, FITCIX, FIVNIK, FODWAY, FODWEC, FOPHOK, FOQZAP, FOQZOD, FUGLUQ, FUGMAX, FUGMEB, FUJJAW, FUNVER, FUPPEM, FUPPIQ, FUZJUH, FUZKAO, GALQIW, GALQOC, GAQXEE, GAQXII, GAQXOO, GASZEI, GASZIM, GASZOS, GASZUY, GATDIQ, GATDOW, GAVYAF, GAYTIL, GAYTOR, GAYTUX, GEGFOO, GEGFUU, GEGGAB, GEGGEF, GEGGEF01, GEGGEF02, GEQQAX, GERJEV, GETCIU, GETSEF, GEYBOD, GEYBUJ, GIFNAN, GIGZON, GIMXUY, GIMYAF, GIVSUC, GIWCEW, GIWJED, GOCTEZ, GOLGUL, GOLGUL01, GOMWIR, GOMWOX, GOZBEE, GUNFOM, GUNFUS, GUNGED, GUQJEJ, GUQJIN, GUQJOT, GUSGUX, GUTWOJ, GUZKIW, GUZSUQ, GUZTOL, GUZTUR, GUZVAZ, HACFAV, HAGPUC, HAGVUJ, HAGWAQ, HAGWEU, HAQXEF, HEDMAH, HENCAF, HEPXUY, HEPYAF, HESJAT, HEYQAG, HEZDIC, HEZDOI, HEZDUO, HEZFAW, HEZQEK, HICHEI, HICHIM, HICHOS, HIYSIU, HIYSOA, HODNAS, HONHUQ, HOXLOX, HOXLUD, HUCLEY, HUFREH, HUFRIL, HUJGUQ, HUJHAX, HUJHAX01, HUYBUZ, IBALEF, IBUGEU, ICIBON, IDIHUB, IDIWAV, IFUYAM, IFUYEQ, IGOCIS, IGOCOY, IGOCUE, IGODAL, IGONEZ, IGONID, IGUCAQ, IGUSUZ, IHUQOT, IJECUX, IJEDAE, IJOCAN, IKICIQ, IKICOW, IKITIH, IKITON, IKITUT, IKIVAB, ILUFAY, ILUNAG, ILUNEK, ILUTAL, ILUVOC, ILUVUI, ILUWAP, ILUWET, ILUWIX, ILUWOD, INOHIE, IPADAG, IPADEK, IPUTUK, IPUVAS, IPUVEW, IQUQUH, IWEHAV, IYESEK, IYESIO, JAKDEH, JAKDIL, JAVXAI, JAYBAP, JEHFUX, JEHFUX01, JEHFUX02, JEHFUX03, JEHVIE, JIMKOG, JIZLUA, JIZMAH, JIZRUI, JIZTET, JIZTIX, JOCBIP, JOCBOV, JOCBUB, JOCHER, JOLLEE, JOLLII, JOMSAI, JONDEY, JONDIC, JONJON, JOWHAG, JOWHEK, JUBZUD, JUCBAM, JUCBEQ, JUGLAA, JUGLEE, JUGLII, JUZQUS, KABZAR, KABZEV, KABZIZ, KACFUS, KACNIO, KACNOU, KAKNAN, KAKNER, KAKNIV, KARSON, KARSUT, KASDIU, KETDAQ, KETDEU, KETDEU01, KETDEU02, KETDEU03, KETDIY, KEXZUL, KEYBAU, KEYBEY, KEYBIC, KEYFOM, KEYFUS, KEZLOR, KILXUB, KIVWUK, KIVXAR, KIVXEV, KIXWIA, KIXWOG, KIXWUM, KOGFUJ, KOJPEG, KOJPIK, KOJPOQ, KOJPUW, KONNIM, KOPHUU, KOPJEG, KOVCAB, KOVCEF, KOVDAC, KUCBER, KUGJUT, KUGKAA, KUPNEQ, KUSPUK, KUWMUL, LABXOE, LABXUK, LABYAR, LABYEV, LABYOF, LABYUL, LACLEJ, LACLIN, LASQUT, LASRAA, LEFYAZ, LEKHER, LEKLEU, LEKLIY, LEKLOE, LEKLUK, LENQUS, LENTOP, LEVWOB, LEWDEZ, LIJPIG, LIJPOM, LIJPUS, LIJQAZ, LISZIY, LIXHUX, LIZSOD, LIZSUJ, LIZTAQ, LIZXEY, LIZXEY01, LIZYIF, LOBPOK, LOHCUJ, LOHMUT, LOKTAJ, LONHUT, LORCAZ, LORQEQ, LUFZAP, LUFZET, LUJWUJ, LUJXAQ, LULCEC, LUPLAL, LUTYEG, LUTYIK, LUTYOQ, LUTYUW, LUTZAD, LUVKIY, MAJDIN, MALNOF, MALNUL, MALPAT, MAPCIR, MAPCOX, MAPCUD, MAWWEP, MAWWIT, MAWWOZ, MAWWUF, MAWXAM, MAXDAT, MAXDEX, MAXDIB, MECQOD, MEKJOC, MELLAT, MELLEX, MELLIB, MELLOH, MELLUN, MELMAU, MEPZOX, MESTOW, MESTUC, MEWPEM, MEXBOJ, MEXBUP, MEZKEJ, MEZKIN, MIFJET, MIGSEB, MIRNAE, MIYPUI, MIYQAP, MIYQET, MIYQIX, MOCZEK, MOCZIO, MODPOM, MODPUS, MODQAZ, MODQED, MOFYUB, MOMQAH, MOMQEL, MOMQOV, MOMREM, MOTLAK, MUSKES, MUSKOC, MUVKEV, NABJEI, NABJEI01, NABJOS, NADTOE, NADTUK, NANXAD, NARSAC, NARSEG, NAZTOY, NEJLEW, NEJLIA, NEJLOG, NEJLUM, NIPKOO, NIPKUU, NIVPIT, NOBDEQ, NOKKEG, NOLJOP, NOLJUV, NOLKAC, NOLKEG, NOLMIM, NOMWOE, NOPTEU, OBIXOP, OBOWUA, OBOXAH, OCEBIL10, OFIWIM, OGEBIN, OGEBIN01, OGEBOT, OGEBUZ, OGECAG, OHEBAG, OHEDEM, OJIQUU, OJIRAB, OJIREF, ONOYOH, OPIMUX, OPOJAF, OQERAE, OQERAE01, OQUSIE, OQUSOK, OQUSUQ, OQUTAX, OQUTEB, OQUTIF, OQUTOL, OSIPOX, OTASUZ, OTEMEH, OTEMIL, OTEMUX, OVAYER, OVAYIV, OXOBUZ, OXOCAG, OXOCEK, OXOCIO, OXOQID, OYEHIK, OYEHIK01, OYULIF, OYULIF01, OYUSOS, OZUXAJ, PADSIZ, PADSOF, PAKCAI, PAKCEM, PARJEZ, PARJID, PATJIG, PATJOM, PATJUS, PATKAZ, PATKED, PATKIH, PAVRAG, PAVVUG, PEMJEY, PEMJIC, PERHUS, PERJAA, PERJEE, PERJII, PERJOO, PERJUU, PERKAB, PESLOR, PEWDUT, PEWFAB, PIDWEF, PIDWEF01, PIDWEF02, PIFJUK, PIFMAV, PIFMAV01, PIFMAV02, PIFMAV03, PIHXAI, PIHXEM, PIJROS, PIXBAB, PIXBEF, PIXJIQ, PIXNER, PIYCUX, PIYDAE, PIYDEI, POBHUM, POBVOT, POBVUZ, POBWAG, POCHAT, POCHEX, POCHIB, POCHOH, POCZAJ, POCZEN, PODFUL, POJPOU, POJPOU01, POJPOU02, POPSUK, POQMOZ, POSBIL, POSBOR, POSCAE, POTHIS, POWPOI, POXQEZ, POXQID, POXQOJ, POXQUP, POXRAW, POXREA, POXRIE, POXROK, PUDMIM, PUJTIZ02, PUKCEF, PUKMUF, PURMEW, PURMUM, PUTBUD, PUTCAK, QAFBEG, QAFBIK, QAFBUW, QAGDOU, QAHSEA, QALTAB, QALTEF, QANCEP, QANCEP01, QANCIT, QANCOZ, QAQTOR, QEFHUH, QEFREB, QEKXEK, QIJFUN, QIWGAG, QOMDUU, QOMFAC, QUDLUY, QUDMAF, QUNCUY, QUNDAF, QUNDEJ, QUNDIN, QURJOE, QURJUK, QURKAR, QURKEV, QURKIZ, QURKOF, QURRUS, QUYDAR, RADHIQ, RAGVOL, RAGVUR, RAGWAY, RAGWEC, RAGWIG, RAGWIG01, RAGWOM, RAQDAR, RARKOM, RASKUU, RASLAB, RASLEF, RASLIJ, RAXWAQ, RAXWEU, RAXWIY, RAXWOE, REFXUX, REFYAE, REFYEI, REGTUU, REGVAC, RERLOS, RETLUX, REXZIF, REYZEC, RIDXEJ, RIDXIN, RIDXOT, RIDXUZ, RIDYAG, RINNEJ, RIVDOS, RIVDUY, RIVFAG, RIWFUB, RIWWEC, RIWWIG, RIYYAC, RODMEF, RODQEI, RODQIM, ROKFAB, ROZFET, ROZFIX, ROZGAQ, ROZGEU, ROZGIY, ROZGOE, ROZGUK, ROZHAR, ROZHEV, ROZHIZ, ROZHOF, ROZHUL, ROZJAT, ROZJEX, RUHNUE, RUHPAM, RUHPEQ, RUSBAK, RUSBEO, RUSYAG, SAFXOO, SAFXOO01, SAFXOO02, SAJCIR, SAJCOX, SAJCUD, SAKPEB, SAKZAH, SALHAQ, SAMXEL, SANROQ, SAQWIS, SAQZER, SAVFEC, SAVFIG, SAVFOM, SAVFUS, SAVGAZ, SAVGED, SAVGIH, SAVGON, SAXDIH, SAXMAI, SEGTAC, SEGTEG, SEGTIK, SEHMEA, SEHMOK, SEJBOA, SEJBUG, SEJDUH, SESLIO, SEVMAK, SICSIJ, SIQWEX, SIQWIB, SIQWOH, SIQWUN, SIQZOJ, SISXEZ, SIYHIU, SIYHIU01, SIYWUV, SIZLOE, SIZLUK, SIZXAC, SIZXAC01, SIZXEG, SOFBAS, SOJJIN, SOJSAO, SOLSUJ, SOMTIA, SOMTOG, SOMTUM, SOQJOY, SOQLEQ, SOQLIU, SOQLOA, SOWJOF, SOYSOQ, SOYSUW, SUCQAK, SUCQEO, SUGGOS, SUHVOI, SUJHAI, SUJHEM, SUJHIQ, SUJHOW, SUJHUC, SUJJAK, SUJJEO, SUJJIS, SUJJOY, SUJJUE, SUJKAL, SUJKEP, SUJKIT, SULKAN, SULKER, SULKIV, SULLAO, SULLES, SULVAY, SULVEC, SUMGEO, SUMGIS, SUMTAX, SUMTEB, SUMTIF, SUPWEH, SUQFIU, SUQQUS, SUQRAZ, SUQRED, SURRAA, SURREE, SUTCER, SUTJUN, SUTKAU, TAFKAP, TAMPOO, TAMPUU, TAMQAB, TAMQEF, TAMQIJ, TAMQIJ01, TAMQOP, TAMQOP01, TAMQUV, TAMRAC, TAMREG, TAMRIK, TAWXUN, TAWYAU, TEDJET, TEDJIX, TEDJIX01, TEDJOD, TEDJUJ, TEDKAQ, TEDKEU, TEDKIY, TEDKOE, TEDKUK, TEGPIF, TEGPOL, TEKTUB, TEQMIN, TEQMUZ, TERFOO, TERYUN, TERZAU, TIMHAA, TIMHEE, TIMHII, TIMHOO, TIMHOO01, TIMHUU, TIMJAC, TIPSIW, TIPSOC, TIPSOC01, TIPSUI, TIPTAP, TOKSAP, TOKSET, TOKSIX, TORMIX, TULQIC, UCEMAT, UCEMEX, UCIQEE, UCIQII, UDICIW, UDICOC, UDICUI, UDOHAY, UDUMEO, UFISAF, UFISEJ, UFISIN, UGETUX, UGEVAF, UJOPOA, UKANIE, UKANOK, UKANUQ, UKANUQ01, UKAVOT, UKAVUZ, UKAWAG, UKAWEK, UKEJOL, ULAQOP, UNEVOA, UNEVUG, UNEWAN, UNEWER, UNEWIV, UNEWOB, UNEWUH, UNIFIG, UNIFIG01, UNIVEU, UNIVIY, UNIVOE, UNIVUK, UNIWAR, UPAYIU, UQIVAT, USILOY, USILUE, USIMAL, UTEPIU, UTEPOA, UTEPUG, UTEQAN, UTEROC, UTEVEW, UVEFOS, UYIWIK, UZAVEY, UZAVIC, VABCUZ, VABZOQ, VABZUW, VACBAF, VAGRUR, VAGRUR01, VAGSAY, VAHRIH, VAWDED, VAWDIH, VAWDIH01, VAWDON, VAWDUT, VAWRET, VEGLEA, VEKWIT, VESRIV, VICVEK, VIDTIN, VIDTOT, VIPCII, VISBAD, VIVWUU, VOBKOO, VOGHEH, VONWIF, VONWOL, VONWUR, VOXLOL, VULHIV, WAKTOT, WAWGIN, WAWGOT, WAWGUZ, WAWHAG, WAWHEK, WAWHIO, WAWHOU, WEDBAL, WELMAD, WELMEH, WELMIL, WEMWIX, WEMWOD, WEMZOF, WEMZUL, WEPGUU, WEPGUU01, WEPGUU02, WEPGUU03, WEPGUU04, WEPGUU05, WEZYEI, WIGQIN, WIHHUR, WINQAN, WINRES, WIWDIR, WIYZEL, WIYZIP, WOFBIE, WOFBIE01, WOFBOK, WOFQUG, WOFRAN, WOFSIW, WOHBED, WOHBED01, WOHBON, WOHBUT, WOHCAA, WOHXUN, WOKPIW, WOKREW, WOKRIA, WOLFOU, WOLFOU01, WOLFOU02, WOMQEX, WOMQIB, WOMSOJ, WORSUT, WORTAA, WUFLAM, WULMIA, WULMOG, WUMXEJ, WUMXIN, WUQJAV, WUQJEZ, WURNAZ, WUXLAD, WUXLAD01, XAHZEO, XAJDAQ, XAWREV, XAWROF, XAWRUL, XAWSAS, XAWSEW, XAYFEK, XAYFIO, XAYFOU, XAYFUA, XEBZEM, XEBZIQ, XEBZIQ01, XEBZOW, XEJQAE, XELCEY, XELCIC, XELCOI, XELCUO, XELDAV, XEPJEK, XEPJIO, XEPJOU, XEPJUA, XEPKAH, XEPKEL, XEPTIY, XEPTOE, XETLAM, XEVPUM, XEXRID, XIHLAD, XIHMEI, XIHZUL, XIJJIL, XIMCIF, XISMAP, XISMET, XISMIX, XISMOD, XISXII, XIXSAB, XIXSEF, XIXSIJ, XIYFAP, XIYFET, XIYFIX, XOGBIF, XOGDON, XOGDUT, XOGDUT01, XOGDUT02, XOGDUT03, XOGDUT04, XOGFAB, XOGFEF, XOGFIJ, XOLQIA, XOLQUM, XOLQUM01, XOLQUM02, XONREA, XOPJAP, XOTROO, XOXGAU, XOXGEY, XUFNAO, XUFNES, XUFNES01, XUKLUM, XUVKEG, XUVNIN, XUVNOT, XUWGOM, XUXFIH, XUXFOL, YACKUK, YAMXIW, YAQWUL, YAZVIG, YEHYIW, YEHYOC, YENCEB, YENCIF, YENRIV, YEPRAP, YEPRET, YESBII, YEWKET, YEWKIX, YEXJAN, YEXJER, YILZEA, YINJIQ, YIPMUG, YIPNAN, YITLEV, YIVJEU, YIVJIY, YIWFIV, YIZMUS, YIZVAH, YOBWIX, YODTOD, YONKAO, YONKES, YOWKUS, YOWLAZ, YOWVOW, YOWVOW01, YOWVOW02, YUCHUB, YUCJAJ, YUJTOO, YUJTUU, YUJVAC, YUKGAO, YUKGES, YUKGOC, YUKGUI, YUKHAP, YUKHIX, YULFES, YURTEM, YURTIQ, YURTOW, ZALYOD, ZARDUT, ZATHAF, ZEDVIQ, ZEFBET, ZEFBIX, ZIFGIG, ZIFYAQ, ZIJNIR, ZILVIC, ZIPLES, ZISYEH, ZIYREG, ZIYRIK, ZOBROA, ZOBSAN, ZOFJIP, ZOFKAI, ZOFKEM, ZOFKIQ, ZOJQEX, ZOKBAF, ZOKBIN, ZOKBOT, ZUCGEL, ZUCGIP, ZULBEP, ZULBOZ, ZUMYOX, ZUMYUD, ZUSWAN, ZUSWER, ZUSWER01, ZUSWIV, ZUSWOB, ZUWLIO, ZUWLOU, ASETOI04, CIMMUI06, COXLIN, COZKUA, FOYXAV, FUJVIS, FUJVOY, GOQKAB, HOKZUF, HOWCUU, JOZPOG, JOZQAT, JUDYEP, KOSQER, KUFWOA, KUFWUG, KULNOX, KULNUD, MOTTOH, MUBQOS, NOVPAS, NUBJEC, NUBTUC, NUBVAK, NUBVEO, QORPIZ, QORRIB, QOVJET, QOVJIX, QOXYEK, QOXYIO, ROVZUA, ROWLOH, ROWLUN, ROWMAU, ROWMEY, SUJQEW, WORPAX, WORPUR, WORRAZ, WORRED, YOXTEN, YOXTIR, YOYXOC, YUBGIO, ZOWFUP, ZUGCUC, ZUJBUE, ZUJCAL, ZUJCEP, GUGKIF, KUKYOH, LUHTEQ, LUHTIU, MUMLAK, OFIWIM01, OGIBIS, QURKEV01, TUGKUE, TUGLAL, UGUBAC, UHERIL, UHEROR, WUHREZ, WUHRID, WUHROJ, XEBZIQ02, XEBZIQ03, XUVNIN01, XUVNOT01