
Cartesian coordinates
                X           Y           Z
AmR1PhR1 3+ (PBE0/6-311G*-RECP)
C                  0.71004300    2.08354400    0.00002500
 C                  2.66923200    0.82681500   -0.00033600
 C                  3.44215400    1.99409500   -0.00041500
 H                  4.52377000    1.92950700   -0.00062400
 C                 -0.71007900    2.08353500    0.00003700
 C                 -1.41189700    3.30255300   -0.00002400
 C                 -2.81968600    3.22390800   -0.00018700
 C                 -3.44218900    1.99405800   -0.00036300
 H                 -3.41343500    4.13323600   -0.00022200
 H                 -4.52380400    1.92945400   -0.00056100
 N                 -1.32494600    0.87264400   -0.00003300
 C                  1.41184800    3.30256900   -0.00005300
 C                  3.25215400   -0.50807300   -0.00061600
 C                  4.57762600   -0.92649200   -0.00089500
 H                  5.47754200   -0.33041200   -0.00096400
 C                  4.51453200   -2.31070700   -0.00108900
 H                  5.29668900   -3.05819300   -0.00135900
 H                  2.86203800   -3.59557000   -0.00112100
 C                 -2.66925300    0.82678700   -0.00030900
 C                 -4.57762000   -0.92655900   -0.00087700
 C                 -4.51449600   -2.31077100   -0.00112400
 H                 -5.47754800   -0.33049700   -0.00089600
 H                 -2.86197300   -3.59559400   -0.00125500
 H                 -5.29663400   -3.05827600   -0.00141500
 C                 -3.25215700   -0.50810900   -0.00061500
 N                 -2.40968000   -1.57664300   -0.00068100
 N                  2.40970200   -1.57663000   -0.00062700
 N                  1.32492300    0.87266000   -0.00004600
 C                  2.81963700    3.22394000   -0.00024100
 H                  3.41337900    4.13327300   -0.00029700
 N                  3.22384000   -2.65297600   -0.00088800
 N                 -3.22379400   -2.65300700   -0.00096700
 C                 -0.68048100    4.52979700    0.00001100
 H                 -1.22814300    5.46651400    0.00001600
 C                  0.68041700    4.52980600   -0.00000500
 H                  1.22806800    5.46652800   -0.00001400
 Am                 0.00001100   -1.14396300    0.00077800


AmR1PhR2 3+ (PBE0/6-311G*-RECP)
C                 -0.72757500    2.07213600   -0.00684200
 C                 -2.66161800    0.77628800    0.15090300
 C                 -3.44961300    1.93951000    0.18058300
 H                 -4.52708400    1.86365100    0.27112300
 C                  0.69011600    2.08092800    0.00477500
 C                  1.39286100    3.29572200    0.05008800
 C                  2.79965500    3.20176600    0.13296900
 C                  3.41202000    1.96674800    0.20136000
 H                  3.40180200    4.10513700    0.16367200
 H                  4.48961200    1.89783000    0.29213700
 N                  1.29861600    0.86919700    0.03045400
 C                 -1.43963600    3.27941900    0.02756100
 C                 -3.17301200   -0.57181700    0.29272500
 C                 -4.43502400   -1.06161900    0.49895400
 H                 -5.39818600   -0.58045300    0.58022600
 H                 -5.04393600   -3.07104400    0.78209100
 C                  2.63399100    0.80142400    0.16288900
 C                  4.48837200   -0.97144100    0.51562800
 C                  4.40248900   -2.35065000    0.60571200
 H                  5.38708600   -0.38136900    0.61177500
 H                  2.73793600   -3.61553500    0.46843900
 H                  5.16183600   -3.10143100    0.77804400
 C                  3.18265100   -0.54466600    0.29438500
 N                  2.33175700   -1.60696500    0.24285100
 N                 -2.27287300   -1.63758400    0.28230800
 N                 -1.32563300    0.85109100    0.02036800
 C                 -2.84856600    3.17546300    0.10191800
 H                 -3.45699300    4.07484100    0.12232500
 N                  3.11886800   -2.68104900    0.43774900
 C                  0.65315100    4.51724800    0.03574000
 H                  1.19181100    5.45909600    0.04882700
 C                 -0.71141000    4.50847700    0.02629300
 H                 -1.26109100    5.44406400    0.03688400
 C                 -2.99979000   -2.73245200    0.48236800
 H                 -2.63550500   -3.74833900    0.54395400
 N                 -4.29169900   -2.41309300    0.61334300
 Am                 0.00721100   -1.07697400   -0.40670600


AmR1PhR3 3+ (PBE0/6-311G*-RECP)
C                  0.77169100    2.06696900    0.00025800
 C                  2.70187900    0.77173600   -0.00287300
 C                  3.50508100    1.91775100   -0.00333800
 H                  4.58665500    1.84139400   -0.00502000
 C                 -0.65024200    2.09957900    0.00029100
 C                 -1.32015500    3.33594800   -0.00017200
 C                 -2.72987700    3.29443400   -0.00157800
 C                 -3.38325300    2.08156800   -0.00309500
 H                 -3.29965400    4.21895000   -0.00185600
 H                 -4.46614700    2.04477600   -0.00467200
 N                 -1.29554600    0.90459400   -0.00040500
 C                  1.50268200    3.27141000   -0.00023100
 C                  3.19124200   -0.59306900   -0.00533700
 H                  5.29692400   -0.51342300   -0.00866100
 C                  4.41342000   -2.42816400   -0.00920700
 H                  5.31064200   -3.02924500   -0.01168100
 H                  2.67028700   -3.76963200   -0.00809200
 C                 -2.64006900    0.89417900   -0.00270600
 C                 -4.59961400   -0.80178000   -0.00732300
 C                 -4.57887100   -2.18732600   -0.00920900
 H                 -5.48128400   -0.17908100   -0.00761900
 H                 -2.96516100   -3.52141300   -0.01030600
 H                 -5.38334000   -2.91070100   -0.01150300
 C                 -3.26175100   -0.42380800   -0.00523000
 N                 -2.45317000   -1.51768600   -0.00570400
 N                  2.33177100   -1.62607400   -0.00510400
 N                  1.35814900    0.84622300   -0.00044000
 C                  2.90766800    3.16082700   -0.00171900
 H                  3.52141500    4.05673400   -0.00197500
 N                 -3.29916400   -2.56839900   -0.00793300
 C                 -0.55933400    4.54584400    0.00026400
 H                 -1.08516800    5.49501300    0.00034800
 C                  0.80114200    4.51520200    0.00022500
 H                  1.37001700    5.43918200    0.00026700
 C                  3.09355700   -2.77582700   -0.00730600
 N                  4.44606000   -1.06114100   -0.00777400
 Am                -0.02824300   -1.16303200    0.00644200


AmR1PhR4 3+ (PBE0/6-311G*-RECP)
C                  0.81632000    2.06264900   -0.00014600
 C                  2.74584700    0.76710200   -0.00028400
 C                  3.55164100    1.90900600   -0.00050300
 H                  4.63180500    1.81659000   -0.00068800
 C                 -0.60627600    2.10598100    0.00004900
 C                 -1.26648500    3.34886400    0.00025200
 C                 -2.67614800    3.32309300    0.00047000
 C                 -3.34398000    2.11835500    0.00035100
 H                 -3.23466400    4.25447200    0.00071800
 H                 -4.42718800    2.09367700    0.00045300
 N                 -1.26823400    0.91800500    0.00001100
 C                  1.55278200    3.26427600   -0.00027100
 C                  3.25640500   -0.59437100   -0.00014600
 C                  4.48705200   -1.21033400   -0.00012500
 H                  5.50420000   -0.84704200   -0.00034300
 H                  4.83040200   -3.31330300    0.00025800
 C                 -2.61443600    0.92383300    0.00008400
 C                 -4.59658200   -0.74670600   -0.00030400
 C                 -4.59291600   -2.13293500   -0.00065900
 H                 -5.47084800   -0.11362600   -0.00014100
 H                 -2.99587700   -3.48789900   -0.00095700
 H                 -5.40668700   -2.84596400   -0.00090800
 C                 -3.25456100   -0.38518100   -0.00018400
 N                 -2.46025700   -1.48980600   -0.00039200
 N                  2.32870200   -1.59438900    0.00007000
 N                  1.40025200    0.83783700   -0.00016900
 C                  2.95731000    3.15317300   -0.00051900
 H                  3.57115200    4.04901500   -0.00074600
 N                 -3.31867600   -2.53071400   -0.00060400
 C                 -0.49912200    4.55384100    0.00017500
 H                 -1.01946000    5.50600000    0.00030200
 C                  0.86019600    4.51333500   -0.00012000
 H                  1.43660900    5.43264100   -0.00023800
 N                  2.89984400   -2.76500800    0.00020700
 N                  4.18593200   -2.52773000    0.00008600
 Am                -0.04689100   -1.16132400    0.00020100


AmR1PhR5 3+ (PBE0/6-311G*-RECP)
C                 -0.73524800    2.06391000   -0.00037900
 C                 -2.66802100    0.77095000   -0.13441800
 C                 -3.46122100    1.92486800   -0.15664400
 H                 -4.53981600    1.84425500   -0.22812000
 C                  0.68652500    2.07838500    0.00500700
 C                  1.37936400    3.30161200   -0.01620300
 C                  2.78842900    3.22859400   -0.08889900
 C                  3.41533900    2.00299000   -0.16928500
 H                  3.37820800    4.14057400   -0.10220100
 H                  4.49425400    1.94607000   -0.25382200
 N                  1.30999600    0.87434800   -0.03232300
 C                 -1.45405800    3.27144600   -0.02776200
 C                 -3.21186800   -0.57563500   -0.24766600
 C                 -4.50971100   -1.05376500   -0.44354500
 H                 -5.45233500   -0.53498800   -0.54007600
 H                 -2.90424000   -3.64553700   -0.39384900
 C                  2.64936700    0.82949400   -0.14376400
 C                  4.52644900   -0.94168500   -0.39480700
 C                  4.43868900   -2.32093200   -0.49219400
 H                  5.43365300   -0.35711600   -0.42387200
 H                  2.76247900   -3.57634600   -0.49654600
 H                  5.20369400   -3.07553500   -0.61845200
 C                  3.21128000   -0.50871500   -0.26158600
 N                  2.35230600   -1.56566800   -0.27083800
 N                 -2.38339200   -1.64742300   -0.20023300
 N                 -1.32859500    0.84628700   -0.02598900
 C                 -2.86046200    3.16636800   -0.09303700
 H                 -3.47150300    4.06423200   -0.11001800
 N                  3.14502900   -2.64554300   -0.40867900
 C                  0.63237900    4.51789300   -0.00516700
 H                  1.16630100    5.46270800   -0.01311200
 C                 -0.73391400    4.50401900   -0.00808000
 H                 -1.28751000    5.43745700   -0.00977000
 N                 -3.20745800   -2.67996300   -0.36787700
 N                 -4.45698800   -2.38074900   -0.51563500
 Am                 0.02779600   -1.10393200    0.33696200

AmR1PhR6 3+ (PBE0/6-311G*-RECP)
C                  0.89477800    2.04122200    0.00004400
 C                  2.78033500    0.69302800    0.00031000
 C                  3.62796400    1.79990500    0.00043600
 H                  4.70578600    1.68036700    0.00068500
 C                 -0.52934900    2.12602300    0.00003200
 C                 -1.14614700    3.38904100   -0.00007800
 C                 -2.55614600    3.41131100   -0.00012100
 C                 -3.26194300    2.22922600   -0.00002700
 H                 -3.08372500    4.36053900   -0.00025900
 H                 -4.34537900    2.24008900   -0.00002500
 N                 -1.22715700    0.95942200    0.00008800
 C                  1.67311200    3.22238100    0.00004200
 C                  3.18739800   -0.70519900    0.00023300
 H                  5.29411900   -0.96589500    0.00024200
 C                  4.05668300   -2.69447700    0.00009900
 H                  4.79940900   -3.48076300    0.00012400
 C                 -2.57174200    1.01009200    0.00007400
 C                 -4.61542800   -0.58374700    0.00011400
 C                 -4.66631600   -1.96902700    0.00032600
 H                 -5.46459200    0.08260700   -0.00024700
 H                 -3.12220000   -3.38455200    0.00121700
 H                 -5.50717300   -2.64985700    0.00036000
 C                 -3.25980700   -0.27509100    0.00022000
 N                 -2.51037500   -1.40976300    0.00056200
 N                  2.23160500   -1.62481500    0.00007900
 N                  1.43844500    0.80746400    0.00010000
 C                  3.07055000    3.06565200    0.00025700
 H                  3.71379200    3.94059700    0.00027300
 N                 -3.40827600   -2.41557400    0.00061700
 C                 -0.33875300    4.57038800   -0.00013200
 H                 -0.83024900    5.53789600   -0.00020600
 C                  1.01858100    4.49174200   -0.00008400
 H                  1.62099800    5.39418400   -0.00015300
 N                  2.76496200   -2.86641400   -0.00005100
 N                  4.35945200   -1.35679700    0.00026100
 Am                -0.07898900   -1.18257600   -0.00025300

AmR1PhR7 3+ (PBE0/6-311G*-RECP)
C                 -0.76202000    2.05831700    0.00848000
 C                 -2.68347000    0.76140400   -0.07041400
 C                 -3.49635100    1.89868100   -0.08581300
 H                 -4.57370800    1.78411100   -0.13201400
 C                  0.65810900    2.09135100    0.00666800
 C                  1.33115100    3.32657100   -0.00846400
 C                  2.74038000    3.27960100   -0.05490000
 C                  3.38964600    2.06440400   -0.10245500
 H                  3.31358000    4.20201000   -0.06531800
 H                  4.47127500    2.02488400   -0.15441000
 N                  1.30029600    0.89559000   -0.01705100
 C                 -1.49721800    3.25725400   -0.00721600
 C                 -3.21077900   -0.59266300   -0.13980900
 H                 -5.31016500   -2.76788400   -0.37542100
 H                 -2.95728000   -3.77253700   -0.24613300
 C                  2.64361400    0.87928700   -0.08613100
 C                  4.58015000   -0.83872600   -0.21115200
 C                  4.53965100   -2.22246100   -0.26537300
 H                  5.46976500   -0.22727700   -0.21392600
 H                  2.90697400   -3.53302000   -0.30415800
 H                  5.33319900   -2.95526100   -0.32802600
 C                  3.24846800   -0.44350500   -0.15616800
 N                  2.42355700   -1.52727300   -0.17425200
 N                 -2.36422700   -1.68413000   -0.12098100
 N                 -1.34382600    0.83281100   -0.00584600
 C                 -2.90375400    3.14388900   -0.04613900
 H                 -3.51942000    4.03854600   -0.05624500
 N                  3.25480300   -2.58746100   -0.23411200
 C                  0.56832200    4.53395600    0.00186300
 H                  1.09136200    5.48470600   -0.00187500
 C                 -0.79395300    4.50103000    0.00345900
 H                 -1.36262700    5.42523600    0.00451700
 N                 -4.47145800   -0.91468500   -0.24113200
 C                 -3.20476500   -2.72017500   -0.22200000
 N                 -4.44236000   -2.24824200   -0.29180000
 Am                 0.03954200   -1.14672700    0.19034300

AmR1PhR8 3+ (PBE0/6-311G*-RECP)
C                  0.80502900    2.03045000   -0.00389700
 C                  2.70589600    0.69310200    0.17598600
 C                  3.53181500    1.82134900    0.21638500
 H                  4.60732700    1.72653700    0.31760600
 C                 -0.62154800    2.08342800   -0.01156500
 C                 -1.27838200    3.32412000    0.01005700
 C                 -2.69114200    3.28729900    0.09004800
 C                 -3.35469600    2.08144000    0.18100800
 H                 -3.25530100    4.21546300    0.10171200
 H                 -4.43436300    2.05935600    0.27205000
 N                 -1.28419700    0.90190500    0.03441600
 C                  1.55747600    3.22063300    0.02794100
 C                  3.13088300   -0.69763700    0.28895900
 H                  5.23487500   -0.75902300    0.59581000
 H                  2.66088000   -3.84755000    0.40572500
 C                 -2.62183700    0.88501800    0.15859900
 C                 -4.53179200   -0.83487300    0.47674900
 C                 -4.48496800   -2.21589400    0.57726100
 H                 -5.41771300   -0.22123500    0.54148500
 H                 -2.84984800   -3.52423500    0.50331600
 H                 -5.26801500   -2.94534100    0.73568200
 C                 -3.21002800   -0.44379400    0.28881200
 N                 -2.38497400   -1.53223800    0.26697800
 N                  2.24974000   -1.71894900    0.22241400
 N                  1.37483300    0.80565300    0.04020300
 C                  2.95884000    3.07702100    0.12423600
 H                  3.59220400    3.95921500    0.14698000
 N                 -3.20643200   -2.58064600    0.44455400
 C                 -0.49727600    4.51967400   -0.00417200
 H                 -1.00464300    5.47914600    0.00198900
 C                  0.86906500    4.47087200    0.00492200
 H                  1.44508700    5.39057500    0.01870600
 N                  4.29552600   -2.55180900    0.56120500
 N                  4.33820900   -1.21930900    0.48934200
 C                  3.02952200   -2.83149200    0.39642200
 Am                -0.05021700   -1.08515200   -0.37938300

AmR2PhR2 3+ (PBE0/6-311G*-RECP)
C                 -0.70969400    2.08387600   -0.00021400
 C                 -2.67683600    0.83285100    0.00836200
 C                 -3.44561400    2.00638000    0.00910400
 H                 -4.52774000    1.94739600    0.01339200
 C                  0.70958500    2.08389600   -0.00007800
 C                  1.40876900    3.30351300    0.00133300
 C                  2.81889800    3.22992900    0.00549500
 C                  3.44551900    2.00651900    0.00991900
 H                  3.40736000    4.14258000    0.00630300
 H                  4.52764400    1.94754400    0.01439800
 N                  1.33088500    0.87151100    0.00168300
 C                 -1.40892700    3.30346800    0.00091000
 C                 -3.25273900   -0.49621500    0.01596300
 C                 -4.54697800   -0.93981400    0.02721600
 H                 -5.49461100   -0.42279300    0.03259300
 H                 -5.26068300   -2.93590200    0.04078100
 H                 -2.87052500   -3.70651500    0.02602000
 C                  2.67678600    0.83297500    0.00860200
 C                  4.54696000   -0.93971900    0.02683600
 H                  5.49459100   -0.42269700    0.03228200
 H                  2.87050300   -3.70642700    0.02527200
 H                  5.26064300   -2.93581000    0.04041500
 C                  3.25272300   -0.49609800    0.01584100
 N                  2.40048200   -1.59707300    0.01369000
 N                 -2.40050000   -1.59719000    0.01399400
 N                 -1.33094000    0.87146900    0.00172900
 C                 -2.81904500    3.22980700    0.00464500
 H                 -3.40755300    4.14242800    0.00511500
 C                 -3.18624900   -2.67261100    0.02401400
 C                  3.18621500   -2.67251900    0.02348400
 N                 -4.46918300   -2.30301600    0.03206700
 N                  4.46914800   -2.30291700    0.03158300
 C                 -0.68077800    4.52994900   -0.00017800
 H                 -1.22921200    5.46613600   -0.00033000
 C                  0.68058500    4.52996100    0.00007500
 H                  1.22900800    5.46615500    0.00017000
 Am                 0.00006600   -1.14861500   -0.02092200

AmR2PhR3 3+ (PBE0/6-311G*-RECP)
C                 -0.65158900    2.10056600    0.00005700
 C                 -2.64779500    0.90066100    0.00003900
 C                 -3.38584100    2.09506100   -0.00014100
 H                 -4.46917400    2.06429400   -0.00022000
 C                  0.76984700    2.06651400    0.00009500
 C                  1.50346100    3.27087100    0.00016100
 C                  2.90818500    3.15948300    0.00022700
 C                  3.50540600    1.91669700    0.00021300
 H                  3.52175200    4.05547000    0.00029600
 H                  4.58689400    1.83972500    0.00020100
 N                  1.35772100    0.84585800    0.00010100
 C                 -1.31640000    3.33746600   -0.00003400
 C                 -3.26028000   -0.41196700    0.00018000
 C                 -4.56706100   -0.81834400    0.00042300
 H                 -5.49956300   -0.27430900    0.00029400
 H                 -5.33817700   -2.79288300    0.00110300
 H                 -2.97075500   -3.63210700    0.00094500
 C                  2.70127600    0.77155400    0.00018300
 H                  5.29809500   -0.50677600    0.00077400
 H                  2.68038500   -3.77030500   -0.00007400
 H                  5.31919500   -3.02276900    0.00080800
 C                  3.19276000   -0.59270000    0.00025600
 N                  2.33654200   -1.62796200   -0.00005700
 N                 -2.44039700   -1.53731700    0.00036800
 N                 -1.30166600    0.90410500    0.00007900
 C                 -2.72857500    3.30177000   -0.00018700
 H                 -3.29328500    4.22931200   -0.00033800
 C                 -3.25673400   -2.58946500    0.00073000
 C                  3.10150800   -2.77562600    0.00012800
 N                 -4.52871000   -2.18287200    0.00079400
 C                 -0.55520400    4.54603500    0.00001400
 H                 -1.08052500    5.49548900   -0.00002000
 C                  0.80554400    4.51497500    0.00012800
 H                  1.37559700    5.43814500    0.00021500
 N                  4.44906700   -1.05709500    0.00059600
 C                  4.42024400   -2.42439800    0.00050100
 Am                -0.02600900   -1.16580200   -0.00036800



AmR2PhR4 3+ (PBE0/6-311G*-RECP)
C                 -0.60916400    2.10624800   -0.00014100
 C                 -2.62310400    0.92861000    0.00014200
 C                 -3.34801600    2.12969900    0.00004600
 H                 -4.43158400    2.11040200    0.00021100
 C                  0.81286800    2.06229200    0.00000800
 C                  1.55118700    3.26427800    0.00016100
 C                  2.95558200    3.15330200    0.00059200
 C                  3.55053500    1.90990300    0.00075700
 H                  3.56859100    4.04967300    0.00080900
 H                  4.63065300    1.81751800    0.00110200
 N                  1.39914000    0.83781100    0.00008800
 C                 -1.26496800    3.34916100   -0.00026800
 C                 -3.25347500   -0.37536400    0.00046300
 C                 -4.56492800   -0.76627800    0.00087600
 H                 -5.49106600   -0.21143700    0.00101100
 H                 -5.35957900   -2.73175800    0.00107800
 H                 -3.00204900   -3.60004800    0.00094600
 C                  2.74462100    0.76828000    0.00044200
 C                  4.49191300   -1.20260100    0.00077600
 H                  5.50735200   -0.83479800    0.00116600
 H                  4.84418000   -3.30396800    0.00036000
 C                  3.25856900   -0.59197500    0.00049900
 N                  2.33525100   -1.59579300    0.00011500
 N                 -2.44801600   -1.51074900    0.00048000
 N                 -1.27532700    0.91624700   -0.00004600
 C                 -2.67704100    3.32853300   -0.00022700
 H                 -3.23089400    4.26261400   -0.00039600
 C                 -3.27651400   -2.55421400    0.00082000
 N                 -4.54268600   -2.13148400    0.00099000
 N                  4.19655000   -2.52120100    0.00038300
 C                 -0.49804000    4.55330400   -0.00030200
 H                 -1.01842500    5.50543600   -0.00049900
 C                  0.86156300    4.51320100   -0.00005800
 H                  1.43856800    5.43205000   -0.00002000
 N                  2.91139000   -2.76400900   -0.00000900
 Am                -0.04378300   -1.16389200   -0.00049800


AmR2PhR5 3+ (PBE0/6-311G*-RECP)
C                 -0.68923000    2.07718000   -0.00663300
 C                 -2.65285200    0.82606500    0.15759700
 C                 -3.41745800    2.00538300    0.18242200
 H                 -4.49642000    1.95225200    0.27144800
 C                  0.73168700    2.06241400    0.00301800
 C                  1.45276700    3.26897100    0.03706900
 C                  2.85815000    3.16075100    0.11441000
 C                  3.45683500    1.91843400    0.18602000
 H                  3.47050600    4.05757600    0.13669900
 H                  4.53442600    1.83639500    0.26960900
 N                  1.32480900    0.84440000    0.03183600
 C                 -1.37953900    3.29964900    0.01696100
 C                 -3.19563100   -0.50891900    0.28845700
 C                 -4.47203900   -0.97076800    0.48018300
 H                 -5.42377400   -0.46698500    0.56137800
 H                 -5.13206500   -2.96752600    0.73085400
 H                 -2.73965800   -3.70147500    0.49551000
 C                  2.66195900    0.76591900    0.15708800
 C                  4.49177200   -1.06491100    0.50330600
 H                  5.43471800   -0.54907100    0.61112300
 H                  2.87462500   -3.64926700    0.44998400
 C                  3.19903500   -0.58268800    0.28444800
 N                  2.36713300   -1.65144100    0.23260900
 N                 -2.32289800   -1.59651700    0.26656600
 N                 -1.31331700    0.87048000    0.03273100
 C                 -2.79096700    3.22684900    0.09454500
 H                 -3.37935100    4.13963800    0.10790700
 C                 -3.07790600   -2.67580700    0.44519700
 N                 -4.36294100   -2.32575200    0.57420200
 C                 -0.63261900    4.51490800    0.00774500
 H                 -1.16625200    5.45987300    0.01524900
 C                  0.73408300    4.50147900    0.01484100
 H                  1.28770800    5.43482400    0.01952100
 N                  3.18371300   -2.68579800    0.41971900
 N                  4.43254000   -2.39100000    0.58461700
 Am                -0.02206300   -1.09417200   -0.38384500

AmR2PhR6 3+ (PBE0/6-311G*-RECP)
C                  0.88983800    2.04159800   -0.00009000
 C                  2.77831000    0.69603500   -0.00001600
 C                  3.62543600    1.80318900   -0.00015500
 H                  4.70328200    1.68426500   -0.00015700
 C                 -0.53379400    2.12617100    0.00001400
 C                 -1.14710700    3.38879400    0.00010800
 C                 -2.55936500    3.41517700    0.00039600
 C                 -3.26723800    2.23852200    0.00049300
 H                 -3.08294100    4.36653400    0.00054100
 H                 -4.35088100    2.25410400    0.00072300
 N                 -1.23490900    0.95745500    0.00004600
 C                  1.66931300    3.22354700   -0.00019700
 C                  3.18976200   -0.70069200    0.00019500
 H                  5.29790700   -0.94880800    0.00005200
 H                  4.81778300   -3.46666700    0.00052800
 C                 -2.58095300    1.01340800    0.00024700
 C                 -4.58355600   -0.60754800    0.00033500
 H                 -5.48773100   -0.01755900    0.00073800
 H                 -3.13060400   -3.49892600   -0.00081400
 H                 -5.45395600   -2.54042300    0.00001800
 C                 -3.25747700   -0.26752600    0.00014500
 N                 -2.49730000   -1.43328700   -0.00028000
 N                  2.23923300   -1.62548600    0.00039400
 N                  1.43638600    0.80841400   -0.00002900
 C                  3.06675600    3.06784500   -0.00025800
 H                  3.70868400    3.94370300   -0.00036400
 C                 -3.36495400   -2.44331300   -0.00040600
 N                 -4.61452400   -1.97210600    0.00001200
 C                  1.01686700    4.49220700   -0.00020200
 H                  1.61929100    5.39455700   -0.00031700
 C                 -0.34088500    4.56967800   -0.00004100
 H                 -0.83292700    5.53690600   -0.00001800
 N                  2.78013800   -2.86425300    0.00052600
 C                  4.07063300   -2.68468300    0.00043100
 N                  4.36580600   -1.34539300    0.00022500
 Am                -0.07538100   -1.18546900   -0.00013900

AmR2PhR7 3+ (PBE0/6-311G*-RECP)
C                  0.66335500    2.07152400   -0.00626000
 C                  2.65039400    0.85129700    0.17419700
 C                  3.39671700    2.04354900    0.19688200
 H                  4.47597600    2.01121500    0.29088400
 C                 -0.76276700    2.03739300   -0.00175300
 C                 -1.50196900    3.23450200    0.01772000
 C                 -2.90838100    3.11356700    0.11430300
 C                 -3.49795100    1.86916700    0.21516500
 H                 -3.52639300    4.00666200    0.12974600
 H                 -4.57139600    1.75754900    0.32021600
 N                 -1.35001600    0.81820800    0.05161500
 C                  1.33518100    3.30498300    0.00906900
 C                  3.21164900   -0.47793400    0.29594200
 C                  4.49711100   -0.90616000    0.51016500
 H                  5.43100700   -0.37538800    0.62055300
 H                  5.21215300   -2.88557200    0.73566900
 H                  2.84743500   -3.68491200    0.42645400
 C                 -2.68205400    0.73298500    0.18071400
 H                 -2.85642700   -3.80447400    0.44158400
 H                 -5.21465900   -2.83539000    0.71976400
 C                 -3.17272000   -0.63405800    0.29833700
 N                 -2.30984400   -1.71500700    0.23855700
 N                  2.37133800   -1.59378600    0.23126800
 N                  1.31053600    0.88016300    0.04500800
 C                  2.74903800    3.25291400    0.09678300
 H                  3.32231000    4.17535800    0.10570900
 C                  3.15537100   -2.64882000    0.40832700
 C                 -3.12406200   -2.75724000    0.41489300
 N                  4.42761200   -2.26389300    0.57656200
 N                 -4.36445800   -2.30422500    0.56342200
 C                  0.57153600    4.50671600   -0.01447900
 H                  1.08928300    5.46057200   -0.01009500
 C                 -0.79856500    4.47387700   -0.01016800
 H                 -1.36261500    5.40105200   -0.00115300
 N                 -4.41879500   -0.97401900    0.49177800
 Am                 0.02944600   -1.09019300   -0.38490300

AmR2PhR8 3+ (PBE0/6-311G*-RECP)
C                  0.61048500    2.10750800    0.00014100
 C                  2.62863800    0.94347600   -0.00040200
 C                  3.34481700    2.15115200   -0.00022800
 H                  4.42857200    2.13999600   -0.00037800
 C                 -0.81109300    2.05058300   -0.00007200
 C                 -1.56639100    3.24443200   -0.00029400
 C                 -2.96788300    3.11241900   -0.00084900
 C                 -3.54636100    1.85848500   -0.00127500
 H                 -3.59559600    3.99863200   -0.00097600
 H                 -4.62635500    1.76097600   -0.00182700
 N                 -1.37961700    0.82250700   -0.00029700
 C                  1.25305500    3.35538800    0.00013000
 C                  3.26418000   -0.35752300   -0.00132400
 C                  4.57738300   -0.74274300   -0.00254300
 H                  5.50112000   -0.18369400   -0.00295800
 H                  5.38088900   -2.70444400   -0.00418600
 H                  3.02842300   -3.58336800   -0.00281500
 C                 -2.72110200    0.73193700   -0.00102100
 H                 -5.31522000   -0.68136100   -0.00233800
 H                 -2.77972300   -3.80976800   -0.00186000
 C                 -3.18994800   -0.64483700   -0.00149100
 N                 -2.32241600   -1.67444100   -0.00136500
 N                  2.46285200   -1.49668100   -0.00131100
 N                  1.28182200    0.92235400    0.00000400
 C                  2.66597700    3.34572900    0.00009300
 H                  3.21377800    4.28342000    0.00016700
 C                  3.29678200   -2.53591700   -0.00242400
 C                 -3.13114800   -2.78736800   -0.00178300
 N                  4.56118700   -2.10769200   -0.00311300
 C                  0.47107900    4.55167300    0.00009400
 H                  0.98114900    5.50952200    0.00017000
 C                 -0.88879000    4.49984600   -0.00010900
 H                 -1.47343500    5.41386300   -0.00022200
 N                 -4.40014800   -2.49054100   -0.00224800
 N                 -4.41778200   -1.15192400   -0.00206300
 Am                 0.05281100   -1.17067700    0.00179100

AmR3PhR3 3+ (PBE0/6-311G*-RECP)
C                  0.00000000    0.71337900   -2.05617400
 C                  0.00016900    2.68786100   -0.79715900
 C                  0.00019100    3.45688100   -1.96941000
 H                  0.00031900    4.54024600   -1.92752600
 C                  0.00000000   -0.71337900   -2.05617400
 C                 -0.00002900   -1.41339900   -3.27601100
 C                 -0.00007800   -2.82371900   -3.19469700
 C                 -0.00019100   -3.45688100   -1.96941000
 H                 -0.00009200   -3.41521600   -4.10561000
 H                 -0.00031900   -4.54024600   -1.92752600
 N                  0.00003200   -1.34360500   -0.85293600
 C                  0.00002900    1.41339900   -3.27601100
 C                  0.00041100    3.21028100    0.55866100
 H                  0.00063500    5.31347000    0.38344000
 H                  0.00101900    5.44438300    2.89102600
 H                  0.00112200    2.83500500    3.75137500
 C                 -0.00016900   -2.68786100   -0.79715900
 H                 -0.00063500   -5.31347000    0.38344000
 H                 -0.00112200   -2.83500500    3.75137500
 H                 -0.00101900   -5.44438300    2.89102600
 C                 -0.00041100   -3.21028100    0.55866100
 N                 -0.00060000   -2.39833900    1.63592600
 N                  0.00060000    2.39833900    1.63592600
 N                 -0.00003200    1.34360500   -0.85293600
 C                  0.00007800    2.82371900   -3.19469700
 H                  0.00009200    3.41521600   -4.10561000
 C                  0.00093200    3.21429100    2.74020800
 C                 -0.00093200   -3.21429100    2.74020800
 C                  0.00095700    4.51999800    2.33269900
 C                 -0.00095700   -4.51999800    2.33269900
 N                  0.00046600    4.48844600    0.96911000
 N                 -0.00046600   -4.48844600    0.96911000
 C                  0.00003200    0.68118200   -4.50227100
 C                 -0.00003200   -0.68118200   -4.50227100
 H                  0.00003700    1.22713300   -5.44003600
 H                 -0.00003700   -1.22713300   -5.44003600
 Am                 0.00000000    0.00000000    1.11931700


AmR3PhR4 3+ (PBE0/6-311G*-RECP)
C                 -0.67156900    2.09129500   -0.00002700
 C                 -2.64986800    0.86627300    0.00004100
 C                 -3.41232300    2.03958400    0.00004100
 H                 -4.49584700    2.00105200    0.00006400
 C                  0.75375200    2.08294700   -0.00004500
 C                  1.45705200    3.30377800    0.00001200
 C                  2.86453500    3.23168000    0.00000400
 C                  3.49165000    2.00464800   -0.00006400
 H                  3.45351700    4.14403800    0.00005900
 H                  4.57391500    1.94136100   -0.00012700
 N                  1.37014800    0.87404600   -0.00007400
 C                 -1.36334900    3.31946100   -0.00000400
 C                 -3.19744500   -0.47628100    0.00008000
 H                 -5.29818900   -0.30482700   -0.00012900
 H                 -5.42248700   -2.81689700   -0.00032100
 H                 -2.81583000   -3.67373200    0.00010600
 C                  2.71656700    0.84067000   -0.00008200
 H                  5.52481800   -0.67907200   -0.00006600
 H                  4.93681800   -3.16734200   -0.00004000
 C                  3.26947500   -0.50451700   -0.00006600
 N                  2.37711600   -1.53619300    0.00001600
 N                 -2.38583400   -1.54699200    0.00012000
 N                 -1.30318400    0.89105300   -0.00001400
 C                 -2.77142200    3.25952400    0.00000700
 H                 -3.35192300    4.17731200   -0.00003700
 C                 -3.19639100   -2.66267300    0.00000500
 C                 -4.49954400   -2.25600900   -0.00016500
 N                 -4.47180800   -0.88890900   -0.00012700
 C                 -0.62719000    4.54290500    0.00002600
 C                  0.73268700    4.53520800    0.00004700
 H                 -1.17049500    5.48214100    0.00002400
 H                  1.28612900    5.46854500    0.00008600
 N                  2.98853700   -2.68567500    0.00005600
 C                  4.52088900   -1.07734900   -0.00006900
 N                  4.26587900   -2.40427300    0.00001600
 Am                -0.01696200   -1.18253500    0.00002100


AmR3PhR5 3+ (PBE0/6-311G*-RECP)
C                  0.73811100    2.06896900    0.00351400
 C                  2.68148000    0.79761700   -0.12449000
 C                  3.47065000    1.95543300   -0.14611600
 H                  4.55106800    1.89386100   -0.21430200
 C                 -0.68629600    2.08204400    0.01181600
 C                 -1.37487400    3.30759300    0.00138300
 C                 -2.78349000    3.24381000   -0.03741300
 C                 -3.41748500    2.01993000   -0.08908400
 H                 -3.36882400    4.15868500   -0.04030600
 H                 -4.49907700    1.96685800   -0.13620000
 N                 -1.31150500    0.87907200   -0.00952600
 C                  1.45387900    3.28388100   -0.01525300
 C                  3.17788200   -0.56003200   -0.20788300
 H                  5.28263400   -0.45454900   -0.31379900
 H                  5.32227800   -2.96654300   -0.40149000
 H                  2.69110300   -3.73947100   -0.29074100
 C                 -2.65375700    0.84586800   -0.08463600
 H                 -5.49612500   -0.37049700   -0.37072600
 H                 -3.04178200   -3.55954600   -0.33939100
 C                 -3.24688800   -0.48096400   -0.18009600
 N                 -2.45180500   -1.57666000   -0.16962700
 N                  2.33006100   -1.60656800   -0.19905300
 N                  1.33963300    0.85839900   -0.03157900
 C                  2.86026600    3.18993300   -0.08053000
 H                  3.46307000    4.09322300   -0.09392800
 C                  3.10230900   -2.74091900   -0.26079000
 C                  4.42122900   -2.37621900   -0.31943100
 N                  4.43861400   -1.01255000   -0.28397400
 C                  0.73461100    4.51526700    0.00520500
 C                 -0.62916500    4.52695000    0.01530500
 H                  1.28829900    5.44853000    0.00062000
 H                 -1.16616800    5.46999700    0.02370700
 N                 -4.55791400   -2.24593500   -0.39074000
 N                 -3.31357900   -2.58506200   -0.29872400
 C                 -4.56635400   -0.91781000   -0.31716600
 Am                -0.00035400   -1.15245800    0.24013800

AmR3PhR6 3+ (PBE0/6-311G*-RECP)
C                 -0.59663800    2.11331200    0.00005400
 C                 -2.60947700    0.95088200   -0.00026400
 C                 -3.33419900    2.14940800   -0.00020400
 H                 -4.41840100    2.14548900   -0.00042200
 C                  0.83120100    2.06461200   -0.00003400
 C                  1.57606900    3.26635500   -0.00002800
 C                  2.97778100    3.14923800   -0.00031500
 C                  3.56920700    1.89990000   -0.00060700
 H                  3.59623300    4.04185900   -0.00039300
 H                  4.64990300    1.80994600   -0.00097100
 N                  1.40822200    0.84577400   -0.00017800
 C                 -1.24641300    3.36194700    0.00017200
 C                 -3.20557700   -0.37127400   -0.00049700
 H                 -5.29919500   -0.11691600   -0.00122800
 H                 -5.52297500   -2.62088500   -0.00163100
 H                 -2.95127300   -3.58037200   -0.00051800
 C                  2.75211100    0.76940600   -0.00049600
 H                  5.31953800   -0.79835800   -0.00148300
 H                  4.91743700   -3.32953500   -0.00094300
 C                  3.20416600   -0.61547600   -0.00071200
 N                  2.28307900   -1.56939600   -0.00017500
 N                 -2.43829300   -1.47358500   -0.00033400
 N                 -1.26318000    0.93262600   -0.00011400
 C                 -2.65617300    3.34825700    0.00003700
 H                 -3.20735900    4.28394000    0.00006400
 C                 -3.29172200   -2.55505400   -0.00065200
 C                 -4.57854900   -2.09695100   -0.00115500
 C                  4.14665100   -2.57074600   -0.00062500
 N                 -4.49635000   -0.73287600   -0.00098200
 C                 -0.47051900    4.56337900    0.00032300
 C                  0.88834100    4.51855800    0.00022300
 H                 -0.98601600    5.51829600    0.00043300
 H                  1.46752600    5.43611100    0.00029500
 N                  2.86194200   -2.79002400   -0.00008800
 N                  4.39991400   -1.22326800   -0.00106900
 Am                -0.04831900   -1.20409300    0.00059000

AmR3PhR7 3+ (PBE0/6-311G*-RECP)
C                  0.71623600    2.07844900    0.00008600
 C                  2.68056700    0.83501800    0.00000600
 C                  3.45281900    2.00181700    0.00012400
 H                  4.53603200    1.95409000    0.00006300
 C                 -0.70590500    2.07563500   -0.00003800
 C                 -1.41087500    3.29321500   -0.00015600
 C                 -2.82040700    3.21856700   -0.00043900
 C                 -3.44588900    1.99028000   -0.00051700
 H                 -3.41128600    4.12978900   -0.00058100
 H                 -4.52678100    1.90293800   -0.00074500
 N                 -1.31981900    0.86444100   -0.00004700
 C                  1.41513500    3.30182400    0.00018200
 C                  3.20646100   -0.51608900   -0.00016800
 H                  5.30893900   -0.38153900    0.00003300
 H                  5.38904100   -2.89612900   -0.00072900
 H                  2.76935800   -3.70673400   -0.00077600
 C                 -2.66220000    0.83216800   -0.00026000
 H                 -3.08473400   -3.69393000    0.00015300
 H                 -5.40994600   -2.61821900   -0.00003800
 C                 -3.23516000   -0.50479300   -0.00017600
 N                 -2.42336700   -1.62144800    0.00000100
 N                  2.37434100   -1.57210200   -0.00055900
 N                  1.33479300    0.87288700    0.00002800
 C                  2.82261200    3.22877200    0.00023100
 H                  3.41245600    4.14062600    0.00034300
 C                  3.16629700   -2.70205400   -0.00060800
 C                 -3.29904500   -2.63392500    0.00003900
 C                  4.47611600   -2.31906400   -0.00054100
 N                  4.47256900   -0.95139500   -0.00023000
 C                  0.68021700    4.52640500    0.00016100
 C                 -0.68075500    4.52205200   -0.00001900
 H                  1.22448500    5.46511700    0.00027100
 H                 -1.23056600    5.45756800   -0.00002800
 N                 -4.50877900   -0.78914000   -0.00019600
 N                 -4.52317700   -2.12439200   -0.00006600
 Am                 0.01094500   -1.17763400    0.00023300

AmR3PhR8 3+ (PBE0/6-311G*-RECP)
C                  0.67025400    2.09359600    0.00002400
 C                  2.65478900    0.88417600   -0.00097300
 C                  3.40703100    2.06533900   -0.00140600
 H                  4.49091600    2.03642600   -0.00208100
 C                 -0.75496900    2.07011200    0.00027200
 C                 -1.47720300    3.28201700    0.00031800
 C                 -2.88224000    3.18655900    0.00035500
 C                 -3.49124600    1.94755100   -0.00003900
 H                 -3.48761400    4.08820200    0.00059700
 H                 -4.57342100    1.87758400   -0.00002700
 N                 -1.35188200    0.85608300    0.00022100
 C                  1.34712200    3.32782600   -0.00025700
 C                  3.20941200   -0.45548300   -0.00137900
 H                  5.30961600   -0.27344700   -0.00288000
 H                  5.44686500   -2.78429400   -0.00208400
 H                  2.84581000   -3.65505200   -0.00022100
 C                 -2.69476600    0.79934300   -0.00022000
 H                 -5.32739400   -0.54013200   -0.00245800
 H                 -2.88321800   -3.74038700   -0.00254600
 C                 -3.20131700   -0.56475700   -0.00121100
 N                 -2.36451200   -1.61934900   -0.00136900
 N                  2.40269700   -1.53069600   -0.00059100
 N                  1.30876000    0.89877700   -0.00021800
 C                  2.75646400    3.28042200   -0.00095400
 H                  3.32997300    4.20265700   -0.00112100
 C                  3.21956400   -2.64141500   -0.00061200
 C                 -3.20488500   -2.70816100   -0.00212000
 C                  4.52102300   -2.22801100   -0.00157500
 N                  4.48592400   -0.86162500   -0.00203100
 N                 -4.44360200   -1.03600200   -0.00210100
 C                  0.59390100    4.54278000   -0.00005000
 C                 -0.76645300    4.52138300    0.00023200
 H                  1.12562100    5.48877200   -0.00011900
 H                 -1.32901600    5.44926500    0.00033600
 N                 -4.46502800   -2.37389900   -0.00303000
 Am                 0.02743700   -1.18844500    0.00141100

AmR4PhR4 3+ (PBE0/6-311G*-RECP)
C                 -0.71286000    2.08948200   -0.00005700
 C                 -2.69277500    0.86811400    0.00021800
 C                 -3.45591300    2.03866900    0.00022000
 H                 -4.53872100    1.98600400    0.00024300
 C                  0.71344500    2.08935900   -0.00013700
 C                  1.40898700    3.31607800   -0.00009200
 C                  2.81664000    3.25812500    0.00010500
 C                  3.45650000    2.03805500    0.00032200
 H                  3.39568600    4.17683100    0.00014200
 H                  4.53929900    1.98519100    0.00052500
 N                  1.34472800    0.88588200   -0.00001000
 C                 -1.40815700    3.31630000    0.00001100
 C                 -3.26435500   -0.46873300    0.00033000
 H                 -5.52189800   -0.61487500    0.00122000
 H                 -4.96517300   -3.11060600    0.00103400
 C                  2.69313400    0.86766700    0.00028500
 H                  5.52186300   -0.61652100    0.00076300
 H                  4.96406800   -3.11195500    0.00071800
 C                  3.26438000   -0.46934500    0.00047000
 N                  2.38561800   -1.51213200    0.00023500
 N                 -2.38604700   -1.51190700   -0.00020800
 N                 -1.34436000    0.88608800    0.00004700
 C                 -2.81583800    3.25860100    0.00012700
 H                 -3.39468700    4.17743200    0.00014300
 N                 -3.01162800   -2.65417800    0.00019500
 N                  3.01067100   -2.65470000    0.00030700
 N                 -4.28453200   -2.35592500    0.00071100
 N                  4.28370900   -2.35701900    0.00051700
 C                 -4.52297700   -1.02560300    0.00085700
 C                  4.52275300   -1.02679700    0.00068900
 C                 -0.67894500    4.54408400   -0.00007300
 H                 -1.22846600    5.47970300   -0.00007300
 C                  0.67997600    4.54397900   -0.00013300
 H                  1.22965700    5.47950300   -0.00016100
 Am                -0.00013400   -1.18254400   -0.00037900


AmR4PhR5 3+ (PBE0/6-311G*-RECP)
C                 -0.64217900    2.09106300   -0.00001000
 C                 -2.63298300    0.88164700    0.00043600
 C                 -3.38171400    2.06310500    0.00021100
 H                 -4.46481700    2.02215700    0.00030000
 C                  0.78082400    2.06946200    0.00012000
 C                  1.49790100    3.28276100    0.00020000
 C                  2.90429500    3.19517600    0.00053800
 C                  3.51942700    1.96093200    0.00079500
 H                  3.50322500    4.10114100    0.00066300
 H                  4.60104100    1.88656200    0.00114500
 N                  1.38553100    0.85350100    0.00027300
 C                 -1.32220000    3.32442000   -0.00015400
 C                 -3.25540500   -0.43370800    0.00089400
 H                 -5.51088000   -0.29564600    0.00150200
 C                  2.73337300    0.80583200    0.00063400
 H                  5.51605200   -0.77432600    0.00154300
 H                  4.87040900   -3.24838400    0.00142100
 C                  3.26532900   -0.54695600    0.00090500
 N                  2.34970200   -1.55824800    0.00058600
 N                 -2.47672800   -1.54121800    0.00093300
 N                 -1.28591200    0.89303400    0.00016600
 C                 -2.73094300    3.27827400   -0.00011800
 H                 -3.30338100    4.20126200   -0.00031400
 N                  2.93408600   -2.72270700    0.00086000
 N                  4.21652300   -2.47006800    0.00126700
 C                 -4.58647900   -0.85459400    0.00136100
 C                  4.50285300   -1.14895600    0.00128200
 C                 -0.57386900    4.54119600   -0.00023900
 H                 -1.10877100    5.48529300   -0.00039800
 C                  0.78589900    4.52113100   -0.00001500
 H                  1.34820600    5.44918900    0.00000200
 N                 -3.35926400   -2.54368200    0.00148900
 H                 -3.10550600   -3.52425400    0.00191900
 N                 -4.60009700   -2.18518200    0.00169300
 Am                -0.01765500   -1.16385000   -0.00104900

AmR4PhR6 3+ (PBE0/6-311G*-RECP)
C                 -0.79354800    2.07171400    0.00005700
 C                 -2.73016500    0.79494400    0.00044500
 C                 -3.53730900    1.93133600    0.00085200
 H                 -4.61869700    1.85039700    0.00131400
 C                  0.63557500    2.11436500   -0.00025100
 C                  1.28731100    3.36284400   -0.00031800
 C                  2.69651400    3.35359000   -0.00057600
 C                  3.37554500    2.15569000   -0.00059300
 H                  3.24456400    4.29111100   -0.00069500
 H                  4.45953400    2.13909400   -0.00093600
 N                  1.30398300    0.93180700   -0.00024500
 C                 -1.53228000    3.27900800    0.00031400
 C                 -3.20022400   -0.58311400    0.00028700
 H                 -5.31741400   -0.74138700    0.00000000
 C                  2.65149200    0.95910800   -0.00032500
 H                  5.53454200   -0.40868600    0.00060200
 H                  5.08136800   -2.92522500    0.00115100
 C                  3.27257500   -0.35598400    0.00010100
 N                  2.43812700   -1.43456600    0.00019500
 N                 -2.29095300   -1.54834400   -0.00012000
 N                 -1.38390900    0.85733800    0.00007600
 C                 -2.93446000    3.17473700    0.00072400
 H                 -3.54404800    4.07343100    0.00094800
 N                  3.11032000   -2.54895200    0.00099000
 N                  4.37049000   -2.19897600    0.00101400
 C                  4.55340100   -0.86022100    0.00059000
 C                 -0.84141300    4.52864500    0.00020500
 H                 -1.41809400    5.44774800    0.00031700
 C                  0.51667500    4.56776600   -0.00010700
 H                  1.03714900    5.51998300   -0.00014900
 N                 -2.88329600   -2.76243100   -0.00049800
 H                 -4.94467000   -3.27757300   -0.00012100
 C                 -4.16503100   -2.52777900   -0.00013500
 N                 -4.40263100   -1.17685300    0.00003000
 Am                 0.03287300   -1.20633600   -0.00021200

AmR4PhR7 3+ (PBE0/6-311G*-RECP)
C                 -0.66432500    2.08210300    0.00000900
 C                 -2.63775400    0.85889500    0.00006300
 C                 -3.40962300    2.02356700    0.00018100
 H                 -4.49130800    1.94672600    0.00024400
 C                  0.75871400    2.07616400   -0.00006200
 C                  1.46153300    3.29779700   -0.00008000
 C                  2.86866900    3.22607400   -0.00012400
 C                  3.49741500    1.99878600   -0.00011200
 H                  3.45742500    4.13863000   -0.00018400
 H                  4.57975000    1.93653900   -0.00012800
 N                  1.37641000    0.86721000   -0.00008000
 C                 -1.36137900    3.30558300    0.00009300
 C                 -3.22826100   -0.47019400    0.00003700
 C                  2.72403800    0.83497000   -0.00008700
 H                  5.52653900   -0.70311700    0.00007800
 H                  4.92023200   -3.18700000    0.00040500
 C                  3.27277900   -0.51142300   -0.00003800
 N                  2.37293700   -1.53690800    0.00005400
 N                 -2.43049000   -1.59666000   -0.00003600
 N                 -1.29335900    0.87650100   -0.00000600
 C                 -2.77116700    3.24492900    0.00019100
 H                 -3.35213500    4.16252100    0.00025800
 N                  2.97581300   -2.69188500    0.00028500
 N                  4.25436200   -2.41924100    0.00030400
 C                  4.51958200   -1.09390800    0.00014500
 C                 -0.62623400    4.53061900    0.00008800
 H                 -1.17186400    5.46854400    0.00012100
 C                  0.73383400    4.52691100   -0.00000500
 H                  1.28449200    5.46189700   -0.00001600
 H                 -5.42783400   -2.55811600    0.00001000
 C                 -3.31788300   -2.59976800   -0.00006900
 H                 -3.11515800   -3.66216600   -0.00012500
 N                 -4.53507700   -2.07489500    0.00000900
 N                 -4.50494200   -0.73953000    0.00009100
 Am                -0.00673000   -1.17666600   -0.00006700


AmR4PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.71396300    2.07714000   -0.00008100
 C                 -2.67081700    0.82646500   -0.00010700
 C                 -3.45587000    1.98123300   -0.00012600
 H                 -4.53864000    1.92163900   -0.00005400
 C                  0.71242000    2.09269400    0.00000900
 C                  1.39285800    3.32567000    0.00013200
 C                  2.80174700    3.28042700    0.00022300
 C                  3.45157000    2.06527500    0.00011300
 H                  3.37362100    4.20367900    0.00038800
 H                  4.53488400    2.02227900    0.00010000
 N                  1.35087900    0.89501400   -0.00002400
 C                 -1.42865500    3.29507900   -0.00014500
 C                 -3.19557800   -0.53028800   -0.00007200
 C                  2.69848300    0.88700400   -0.00000900
 H                  5.53393800   -0.58696900   -0.00015200
 H                  4.98528400   -3.08436700   -0.00045300
 C                  3.27588900   -0.44763500   -0.00011400
 N                  2.40038400   -1.49386100   -0.00010500
 N                 -2.37200200   -1.59529800    0.00002800
 N                 -1.32571900    0.86844200   -0.00009900
 C                 -2.83408300    3.21354600   -0.00018100
 H                 -3.42971000    4.12167300   -0.00025800
 N                  3.02984800   -2.63372300   -0.00020700
 N                  4.30199800   -2.33182300   -0.00026500
 C                  4.53616200   -1.00079200   -0.00020800
 C                 -0.71321000    4.53094800   -0.00008300
 H                 -1.27199100    5.46108500   -0.00019200
 C                  0.64632000    4.54493200    0.00008900
 H                  1.18406200    5.48752300    0.00019800
 C                 -3.22509600   -2.67530700    0.00010500
 H                 -2.91499200   -3.71115700    0.00016800
 N                 -4.44306800   -0.98673300   -0.00010500
 H                 -5.32114400   -0.48063700   -0.00021500
 N                 -4.48035600   -2.32467200   -0.00004400
 Am                 0.01012500   -1.18878400    0.00009400


AmR5PhR5 3+ (PBE0/6-311G*-RECP)
C                 -0.71014700    2.06705400    0.00336400
 C                 -2.66526800    0.80539400   -0.11697800
 C                 -3.44303600    1.97038000   -0.12426900
 H                 -4.52335300    1.90543000   -0.18511400
 C                  0.71630600    2.06419200   -0.00272500
 C                  1.42227300    3.28241300   -0.01977100
 C                  2.83049200    3.20082000   -0.10022900
 C                  3.44738700    1.97036200   -0.18449600
 H                  3.42676800    4.10867900   -0.11276000
 H                  4.52597600    1.90431200   -0.27034100
 N                  1.32795500    0.85699300   -0.05063200
 C                 -1.41422400    3.28505100   -0.01252000
 C                 -3.23042900   -0.53042200   -0.24029200
 H                 -5.47144100   -0.44681900   -0.52834200
 C                  2.66945800    0.80533800   -0.15608600
 H                  5.48093800   -0.48659600   -0.45811900
 C                  3.22925400   -0.53284500   -0.25571500
 N                  2.40239200   -1.60648500   -0.23934600
 N                 -2.42097700   -1.61788500   -0.20779600
 N                 -1.32195100    0.86111300   -0.01751800
 C                 -2.82384500    3.20203100   -0.06176000
 H                 -3.42095300    4.10945500   -0.06779000
 N                 -4.50808400   -2.30930000   -0.52980200
 N                  4.48933200   -2.33458900   -0.46604100
 C                 -4.53752100   -0.98287700   -0.44055700
 C                  4.53620000   -1.00730200   -0.39750300
 C                 -0.68087300    4.50673500    0.00725100
 H                 -1.22178900    5.44775900    0.01538400
 C                  0.69015700    4.50491200   -0.00049200
 H                  1.23315300    5.44473500   -0.01164800
 N                 -3.26317500   -2.63176300   -0.38843600
 H                 -2.97708600   -3.60262100   -0.42689900
 N                  3.23502500   -2.63691600   -0.36578400
 H                  2.93530300   -3.60318800   -0.41578400
 Am                 0.00222900   -1.12122900    0.32563700



AmR5PhR6 3+ (PBE0/6-311G*-RECP)
C                 -0.56832200    2.11168400    0.00010100
 C                 -2.59319900    0.96631800   -0.00015800
 C                 -3.30431800    2.17219500   -0.00031400
 H                 -4.38818900    2.16564900   -0.00050800
 C                  0.85724000    2.05054700   -0.00004400
 C                  1.61498300    3.24520100   -0.00000200
 C                  3.01513700    3.11399300   -0.00018400
 C                  3.59553400    1.85834700   -0.00050600
 H                  3.64245700    4.00050600   -0.00006500
 H                  4.67537900    1.75817900   -0.00069500
 N                  1.42350400    0.82609000   -0.00031700
 C                 -1.20652000    3.36518900    0.00005800
 C                 -3.26223200   -0.32659800   -0.00050000
 H                 -5.51153100   -0.10491400   -0.00053500
 C                  2.76842900    0.73659100   -0.00061600
 H                  5.30875500   -0.89040500   -0.00126200
 C                  3.19935600   -0.65420600   -0.00071600
 N                  2.25508000   -1.58640000   -0.00032300
 N                 -2.52622700   -1.46237300   -0.00067600
 N                 -1.24719700    0.93379400    0.00012500
 C                 -2.61634400    3.36583500   -0.00013100
 H                 -3.15893100    4.30666500   -0.00017800
 N                 -4.67185500   -2.02665400   -0.00105500
 C                 -4.60830700   -0.69747800   -0.00069100
 C                 -0.41919700    4.55999400    0.00011700
 H                 -0.92672600    5.51922700    0.00015000
 C                  0.93919100    4.50356500    0.00015500
 H                  1.52658800    5.41591700    0.00031600
 N                 -3.44482100   -2.43049700   -0.00095300
 H                 -3.22693200   -3.41984400   -0.00132800
 N                  2.80225900   -2.82147600   -0.00046300
 N                  4.37825600   -1.29198200   -0.00091900
 C                  4.09178700   -2.63397700   -0.00069500
 H                  4.84406400   -3.41140100   -0.00081600
 Am                -0.04828600   -1.18680300    0.00065000

AmR5PhR7 3+ (PBE0/6-311G*-RECP)
C                  0.70134400    2.06868800    0.00810700
 C                  2.65975700    0.81747200   -0.13915800
 C                  3.43047500    1.98683000   -0.16277800
 H                  4.50969300    1.92658300   -0.24483700
 C                 -0.72071400    2.06161900    0.00713400
 C                 -1.43780800    3.27008300   -0.02227600
 C                 -2.84673000    3.17285100   -0.08865300
 C                 -3.45483300    1.93509600   -0.15151900
 H                 -3.45168500    4.07480200   -0.10893700
 H                 -4.53200200    1.83667400   -0.23026700
 N                 -1.31964800    0.84683400   -0.01248400
 C                  1.39849900    3.29051600   -0.01094500
 C                  3.22555400   -0.51810700   -0.25149900
 H                  5.47656400   -0.46333000   -0.44801700
 C                 -2.65820500    0.78566700   -0.12274100
 C                 -3.19168100   -0.56420500   -0.23695600
 N                 -2.36284600   -1.67081300   -0.19808100
 N                  2.40131100   -1.59378400   -0.25265500
 N                  1.31895200    0.86190800   -0.03445200
 C                  2.80667000    3.21498200   -0.08325700
 H                  3.39918800    4.12525500   -0.09555200
 N                  4.48981200   -2.31395300   -0.48531200
 C                  4.53323900   -0.98747000   -0.39707500
 C                  0.65478400    4.50866600    0.00085000
 H                  1.19141400    5.45200500   -0.00744500
 C                 -0.71249500    4.49944100   -0.00244900
 H                 -1.26209500    5.43530400   -0.00334100
 N                  3.23680800   -2.62178000   -0.39271300
 H                  2.93938100   -3.58755900   -0.45878600
 C                 -3.21194900   -2.68821800   -0.37251600
 H                 -2.97845500   -3.74348600   -0.41002900
 N                 -4.43797500   -2.19468600   -0.49840900
 H                 -5.30742300   -2.69838600   -0.64322100
 N                 -4.44985800   -0.86388000   -0.41568400
 Am                 0.00867500   -1.12242400    0.32456200


AmR5PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.64563000    2.09222100   -0.00010200
 C                 -2.64025300    0.89576700    0.00073300
 C                 -3.38097700    2.08354200    0.00064000
 H                 -4.46442800    2.05019300    0.00102700
 C                  0.77721900    2.05819700    0.00007300
 C                  1.51084100    3.26398900    0.00019600
 C                  2.91472500    3.15612100    0.00076500
 C                  3.51417300    1.91134800    0.00135100
 H                  3.52798700    4.05253700    0.00082100
 H                  4.59577700    1.83229500    0.00187400
 N                  1.36493300    0.83863700    0.00035300
 C                 -1.31290600    3.33042800   -0.00017500
 C                 -3.26747800   -0.41713300    0.00161300
 H                 -5.52240000   -0.27102500    0.00304500
 C                  2.70898100    0.77071200    0.00113800
 H                  5.32289100   -0.61581600    0.00290200
 C                  3.19737400   -0.59886500    0.00169100
 N                  2.33912400   -1.63769300    0.00120900
 N                 -2.49159400   -1.52738600    0.00144800
 N                 -1.29412700    0.89853500    0.00017800
 C                 -2.72269800    3.29483900    0.00012100
 H                 -3.28945700    4.22138500    0.00005100
 N                 -4.61784000   -2.16378300    0.00326200
 C                 -4.59977300   -0.83308600    0.00264200
 C                 -0.54988100    4.54000700   -0.00033600
 H                 -1.07498900    5.48974400   -0.00052900
 C                  0.81027300    4.50880200   -0.00012300
 H                  1.37993500    5.43238200   -0.00015800
 N                 -3.37840800   -2.52640400    0.00246400
 H                 -3.12967400   -3.50831000    0.00295500
 N                  4.42908300   -1.09428200    0.00241400
 C                  3.15900900   -2.74427800    0.00199000
 H                  2.81864300   -3.77061100    0.00197000
 N                  4.42408400   -2.43296900    0.00264800
 Am                -0.02556900   -1.17127400   -0.00194900

AmR6PhR6 3+ (PBE0/6-311G*-RECP)
C                 -0.71636300    2.07221300   -0.04321200
 C                 -2.66492700    0.81378900    0.18009800
 C                 -3.44390500    1.97292500    0.23920200
 H                 -4.51892800    1.92080600    0.37183700
 C                  0.71625000    2.07224600   -0.04317600
 C                  1.41840900    3.29113600    0.01510100
 C                  2.82213000    3.20488500    0.13265900
 C                  3.44378300    1.97308500    0.23936500
 H                  3.41789600    4.11232700    0.17084900
 H                  4.51880100    1.92101700    0.37206000
 N                  1.33443900    0.87239100   -0.00123400
 C                 -1.41858200    3.29107100    0.01502500
 C                 -3.12430100   -0.56525600    0.33672200
 H                 -5.22153800   -0.64130800    0.66559000
 H                 -4.92057100   -3.17936200    0.81796300
 C                  2.66486800    0.81391100    0.18019500
 H                  5.22157900   -0.64104500    0.66553900
 H                  4.92078000   -3.17913000    0.81777500
 C                  3.12432300   -0.56511000    0.33676300
 N                  2.24284600   -1.56425400    0.28532200
 N                 -2.24274000   -1.56433600    0.28541100
 N                 -1.33449800    0.87233600   -0.00128700
 C                 -2.82230500    3.20475300    0.13250500
 H                 -3.41811700    4.11216700    0.17064900
 N                 -2.87002100   -2.74592700    0.46746400
 N                  2.87020500   -2.74581600    0.46728500
 C                 -4.13136000   -2.46168100    0.63905200
 C                  4.13152100   -2.46148900    0.63891400
 N                 -4.32987600   -1.11065400    0.56265600
 N                  4.32994900   -1.11044600    0.56257700
 C                  0.68144900    4.51748400    0.00055700
 H                  1.22472300    5.45685100    0.01758800
 C                 -0.68167900    4.51745300    0.00051900
 H                 -1.22499700    5.45679500    0.01751900
 Am                 0.00002500   -1.11379600   -0.42617300

AmR6PhR7 3+ (PBE0/6-311G*-RECP)
C                  0.83373800    2.05906300   -0.00015600
 C                  2.75885400    0.76802800   -0.00062300
 C                  3.57287100    1.89956500   -0.00075100
 H                  4.65378700    1.81212300   -0.00102800
 C                 -0.59210900    2.10358000    0.00002700
 C                 -1.24910000    3.34706100    0.00021600
 C                 -2.66042900    3.33128100    0.00035800
 C                 -3.33478900    2.13011100    0.00016500
 H                 -3.21306500    4.26620100    0.00054000
 H                 -4.41834500    2.08603100    0.00017300
 N                 -1.25497200    0.91705500   -0.00007900
 C                  1.57661300    3.26297900   -0.00021500
 C                  3.20789800   -0.61705100   -0.00072500
 H                  5.32097300   -0.81553400   -0.00061400
 H                  4.90111400   -3.34438700   -0.00020900
 C                 -2.59832400    0.94123500   -0.00010400
 H                 -5.51289000   -2.36889400   -0.00145800
 C                 -3.23432900   -0.36735100   -0.00054900
 N                 -2.48082900   -1.52317500   -0.00104100
 N                  2.27970800   -1.56535900   -0.00068500
 N                  1.41347600    0.84134000   -0.00031600
 C                  2.97807100    3.14838300   -0.00052100
 H                  3.59503000    4.04208100   -0.00061000
 N                  2.84947000   -2.79070100   -0.00039100
 C                  4.13529600   -2.58046800   -0.00035200
 N                  4.39812900   -1.23392500   -0.00055200
 C                 -0.47554600    4.55106500    0.00021300
 H                 -0.99453400    5.50413100    0.00038200
 C                  0.88370000    4.51191200   -0.00001200
 H                  1.45888800    5.43198900   -0.00004500
 C                 -3.40557900   -2.49122300   -0.00122600
 H                 -3.24298200   -3.56055900   -0.00164700
 N                 -4.60233000   -1.92014800   -0.00119600
 N                 -4.52065200   -0.58730300   -0.00063400
 Am                -0.03687400   -1.20007000    0.00067700



AmR6PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.78985400    2.07650500    0.00005000
 C                 -2.73529000    0.81786900    0.00031900
 C                 -3.53069000    1.96356600    0.00081300
 H                 -4.61294700    1.89410500    0.00116400
 C                  0.64000000    2.10089600   -0.00010500
 C                  1.31338400    3.33979000   -0.00027700
 C                  2.72118700    3.30399900   -0.00060300
 C                  3.38022000    2.09191500   -0.00050800
 H                  3.28809200    4.23033500   -0.00086200
 H                  4.46433700    2.06643100   -0.00065000
 N                  1.28678000    0.91107600    0.00000100
 C                 -1.51175900    3.29142000    0.00036000
 C                 -3.21320600   -0.55838500    0.00023900
 H                 -5.33121200   -0.70934600    0.00077900
 H                 -4.96819200   -3.24642900    0.00009700
 C                  2.63184300    0.91169500   -0.00009700
 C                  3.20509900   -0.42627500    0.00033700
 N                  2.42511300   -1.52282300    0.00138300
 N                 -2.30742000   -1.52736600   -0.00008300
 N                 -1.38944800    0.86854600   -0.00003300
 C                 -2.91570000    3.20157500    0.00080900
 H                 -3.51713800    4.10582900    0.00115600
 N                 -2.90428300   -2.73862400   -0.00023400
 C                 -4.18559700   -2.49957100    0.00006000
 N                 -4.41766400   -1.14786900    0.00044000
 C                  0.55805800    4.55464500   -0.00010600
 H                  1.08955500    5.50077500   -0.00023600
 C                 -0.80095600    4.53190300    0.00024200
 H                 -1.36440200    5.45934000    0.00043500
 C                  3.31929300   -2.56753100    0.00157100
 H                  3.04987500   -3.61473700    0.00244100
 N                  4.47038100   -0.83309900    0.00020700
 H                  5.32808300   -0.29320100   -0.00065800
 N                  4.56058000   -2.16775800    0.00090900
 Am                 0.02094200   -1.21149200   -0.00042600



AmR7PhR7 3+ (PBE0/6-311G*-RECP)
C                  0.70983000    2.06898400   -0.00005500
 C                  2.66884400    0.82633100    0.00012600
 C                  3.45041500    1.98454100    0.00022200
 H                  4.53144800    1.89856500    0.00034200
 C                 -0.70982500    2.06898200   -0.00005000
 C                 -1.41412600    3.28737700   -0.00000300
 C                 -2.82336600    3.21308200    0.00009200
 C                 -3.45041100    1.98454100    0.00019300
 H                 -3.41406400    4.12448100    0.00012000
 H                 -4.53144300    1.89856400    0.00031700
 N                 -1.32506800    0.85757800   -0.00000700
 C                  1.41413100    3.28737900   -0.00000500
 C                  3.23876200   -0.51119700    0.00026600
 C                 -2.66883900    0.82633000    0.00016800
 C                 -3.23876700   -0.51119400    0.00035100
 N                 -2.42063800   -1.62455300    0.00002400
 N                  2.42063000   -1.62455100    0.00001100
 N                  1.32507100    0.85758100   -0.00001900
 C                  2.82337000    3.21308400    0.00012300
 H                  3.41407000    4.12448200    0.00017800
 C                  3.29211100   -2.64192200    0.00032600
 H                  3.07331000   -3.70102300    0.00030800
 C                 -3.29212800   -2.64191600    0.00044100
 H                 -3.07333600   -3.70101900    0.00044600
 C                  0.68059700    4.51373500   -0.00000400
 H                  1.22743200    5.45099500    0.00001600
 C                 -0.68059400    4.51373400   -0.00003500
 H                 -1.22743000    5.45099300   -0.00002700
 N                  4.51034500   -0.80238400    0.00066700
 N                 -4.51035100   -0.80237000    0.00058100
 N                 -4.51787900   -2.13798200    0.00075200
 H                 -5.40248600   -2.63606800    0.00103300
 N                  4.51786500   -2.13799600    0.00076800
 H                  5.40246800   -2.63608900    0.00114800
 Am                 0.00000200   -1.17118300   -0.00038200


AmR7PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.66525600    2.08403000    0.00000500
 C                 -2.64363500    0.87516200   -0.00003600
 C                 -3.40666100    2.04693300   -0.00006500
 H                 -4.48903100    1.97868700   -0.00011500
 C                  0.75771000    2.06413600   -0.00001700
 C                  1.47841900    3.27768100    0.00001300
 C                  2.88320000    3.18406200   -0.00004400
 C                  3.49498600    1.94537300   -0.00010500
 H                  3.48744500    4.08651900   -0.00004300
 H                  4.57730000    1.87730300   -0.00019400
 N                  1.35702500    0.85069900   -0.00006500
 C                 -1.34864100    3.31309900    0.00002000
 C                 -3.23985600   -0.45127800   -0.00005500
 C                  2.70113900    0.79657300   -0.00010100
 C                  3.20482100   -0.56778800   -0.00007800
 N                  2.36125400   -1.61839800    0.00001000
 N                 -2.44659300   -1.58167000   -0.00011800
 N                 -1.30018200    0.88333900    0.00000600
 C                 -2.75962400    3.26403000   -0.00002400
 H                 -3.33426700    4.18565600   -0.00003100
 C                 -3.33959800   -2.58009600   -0.00010100
 H                 -3.14337700   -3.64374700   -0.00012900
 C                  3.19650900   -2.71287600   -0.00000200
 H                  2.86987000   -3.74357900    0.00003900
 C                 -0.59743200    4.53030800    0.00006800
 H                 -1.13227900    5.47458000    0.00010600
 C                  0.76320600    4.51405000    0.00007000
 H                  1.32215700    5.44412100    0.00011500
 N                 -4.51754000   -0.71454000   -0.00007300
 N                 -4.55436700   -2.04942100   -0.00012700
 H                 -5.44965200   -2.52839100   -0.00015100
 N                  4.45742000   -2.38482400   -0.00008200
 N                  4.44355300   -1.04612600   -0.00014000
 H                  5.33019200   -0.55494900   -0.00018400
 Am                -0.01598000   -1.18368400    0.00007800

AmR8PhR8 3+ (PBE0/6-311G*-RECP)
C                  0.71326000    2.08001300   -0.00025900
 C                  2.67653400    0.84495000   -0.00046100
 C                  3.45153600    2.00766200   -0.00006400
 H                  4.53486400    1.95773900    0.00021200
 C                 -0.71333400    2.07999500   -0.00026500
 C                 -1.41308200    3.30420300   -0.00007900
 C                 -2.81994500    3.23520200    0.00003300
 C                 -3.45161000    2.00756700   -0.00004500
 H                 -3.40864800    4.14791100    0.00024100
 H                 -4.53493500    1.95759900    0.00003900
 N                 -1.33212600    0.87662900   -0.00035200
 C                  1.41297100    3.30423600    0.00007900
 C                  3.20812700   -0.50953700   -0.00055600
 H                  5.33366200   -0.44997800   -0.00085700
 C                 -2.67655900    0.84488300   -0.00033700
 H                 -5.33364800   -0.45009400   -0.00103800
 C                 -3.20811900   -0.50962000   -0.00035100
 N                 -2.38887900   -1.57871800    0.00014800
 N                  2.38891300   -1.57865700   -0.00021600
 N                  1.33208300    0.87665100   -0.00057400
 C                  2.81983700    3.23528000    0.00020100
 H                  3.40850500    4.14801200    0.00054700
 N                  4.45766100   -0.96009500   -0.00053900
 N                 -4.45764300   -0.96020500   -0.00064800
 C                  3.24773000   -2.65405200   -0.00048700
 H                  2.94406400   -3.69184700   -0.00037500
 C                 -3.24767500   -2.65412000    0.00005300
 H                 -2.94398100   -3.69190700    0.00040400
 N                  4.50146800   -2.29732200   -0.00025200
 N                 -4.50143100   -2.29743300   -0.00076400
 C                  0.68001400    4.53183400    0.00027400
 H                  1.22710000    5.46905300    0.00051000
 C                 -0.68015800    4.53181900    0.00015100
 H                 -1.22726600    5.46902500    0.00025700
 Am                 0.00003000   -1.19487800    0.00037000


EuR1PhR1 3+ (PBE0/6-311G*-RECP)
C                 -0.73325800    1.90204300   -0.00005300
 C                 -2.71857600    0.70465300    0.00019300
 C                 -3.48101100    1.88779800    0.00022600
 H                 -4.56287500    1.84123900    0.00035900
 C                  0.73325800    1.90204300   -0.00004900
 C                  1.42680100    3.14288400   -0.00001000
 C                  2.84210300    3.10012200    0.00008900
 C                  3.48101100    1.88779800    0.00022300
 H                  3.41218800    4.02442400    0.00009300
 H                  4.56287500    1.84123900    0.00034600
 N                  1.36193700    0.72936300    0.00000200
 C                 -1.42680100    3.14288400   -0.00001100
 C                 -3.35229600   -0.59748100    0.00046400
 C                 -4.72473500   -0.90639300    0.00091700
 H                 -5.57373300   -0.24031900    0.00108400
 C                 -4.77663500   -2.28118200    0.00111600
 H                 -5.61074500   -2.96873000    0.00144000
 H                 -3.20901400   -3.68027500    0.00069400
 C                  2.71857500    0.70465300    0.00021000
 C                  4.72473500   -0.90639300    0.00081700
 C                  4.77663600   -2.28118200    0.00107800
 H                  5.57373300   -0.24031900    0.00090200
 H                  3.20901400   -3.68027500    0.00099700
 H                  5.61074500   -2.96873000    0.00140300
 C                  3.35229600   -0.59748100    0.00046800
 N                  2.60652600   -1.73161400    0.00047400
 N                 -2.60652600   -1.73161400    0.00046200
 N                 -1.36193700    0.72936300   -0.00000900
 C                 -2.84210300    3.10012200    0.00009500
 H                 -3.41218800    4.02442400    0.00010500
 N                 -3.50228600   -2.71333300    0.00070900
 N                  3.50228600   -2.71333300    0.00085200
 C                  0.70015300    4.34508400   -0.00004700
 H                  1.23128600    5.29263700   -0.00005300
 C                 -0.70015300    4.34508400   -0.00004600
 H                 -1.23128700    5.29263700   -0.00005100
 Eu                 0.00000000   -1.46174800   -0.00093400


EuR1PhR2 3+ (PBE0/6-311G*-RECP)
C                  0.75960400    1.89362400    0.00356200
 C                  2.73432000    0.67806700   -0.01781300
 C                  3.51185500    1.85943300   -0.02106400
 H                  4.59382600    1.80560600   -0.03193700
 C                 -0.70509100    1.90918700    0.00386200
 C                 -1.37970200    3.15274800    0.00023600
 C                 -2.79216600    3.12820800   -0.00848400
 C                 -3.44757000    1.92220600   -0.01969000
 H                 -3.35173700    4.05885300   -0.00939400
 H                 -4.52990800    1.89053500   -0.03072900
 N                 -1.34931300    0.74017600   -0.00019100
 C                  1.46934300    3.13324700   -0.00083400
 C                  3.32998700   -0.62548800   -0.03780800
 C                  4.68184200   -0.96708000   -0.07395200
 H                  5.58307800   -0.37181500   -0.09069400
 H                  5.55251000   -2.88175600   -0.11618500
 C                 -2.70216000    0.73068600   -0.01783800
 C                 -4.73108000   -0.85385200   -0.07106300
 C                 -4.80382200   -2.22890800   -0.09058900
 H                 -5.56993900   -0.17529300   -0.07990600
 H                 -3.25860900   -3.65129900   -0.08110300
 H                 -5.64880100   -2.90231300   -0.11719400
 C                 -3.35682500   -0.56667600   -0.04004800
 N                 -2.62876700   -1.70927900   -0.04004500
 N                  2.57460900   -1.78981700   -0.03156800
 N                  1.37622200    0.71560000    0.00046700
 C                  2.88693700    3.07299600   -0.01019000
 H                  3.46479300    3.99221900   -0.01147800
 N                 -3.53891700   -2.68123000   -0.07057600
 C                 -0.63472600    4.35258800    0.00288700
 H                 -1.15901800    5.30392100    0.00332200
 C                  0.76009600    4.34053200    0.00218500
 H                  1.30178100    5.28161900    0.00188500
 C                  3.43960400   -2.77677200   -0.06280200
 H                  3.21235100   -3.83401800   -0.06832700
 N                  4.71529900   -2.31079600   -0.08907600
 Eu                -0.03741200   -1.46344900    0.07945000

EuR1PhR3 3+ (PBE0/6-311G*-RECP)
C                  0.80589400    1.86836100    0.00064800
 C                  2.75396200    0.61584700   -0.00343500
 C                  3.55819900    1.77555500   -0.00407200
 H                  4.64027200    1.71241700   -0.00606100
 C                 -0.65569300    1.91460700    0.00076600
 C                 -1.30020200    3.17211700    0.00029400
 C                 -2.71239900    3.17967400   -0.00129300
 C                 -3.39535400    1.98926100   -0.00350500
 H                 -3.25070900    4.12273900   -0.00130000
 H                 -4.47821200    1.98281400   -0.00549400
 N                 -1.32756400    0.75830100   -0.00016900
 C                  1.54288100    3.09448200   -0.00008400
 C                  3.29320200   -0.71085200   -0.00712000
 H                  5.40870900   -0.42415800   -0.01670900
 C                  4.71593100   -2.39089300   -0.01671300
 H                  5.66378800   -2.91132300   -0.02216300
 H                  3.08533100   -3.90108400   -0.01147100
 C                 -2.67821800    0.78005800   -0.00333300
 C                 -4.74613900   -0.75505000   -0.01343400
 C                 -4.85317200   -2.12844100   -0.01697000
 H                 -5.56811700   -0.05610200   -0.01527500
 H                 -3.34454600   -3.58927800   -0.01448900
 H                 -5.71510800   -2.78057900   -0.02195000
 C                 -3.36589500   -0.50183500   -0.00749100
 N                 -2.66614500   -1.66209900   -0.00746300
 N                  2.54308500   -1.83373600   -0.00558100
 N                  1.39814500    0.67934500   -0.00003000
 C                  2.95580600    3.00369100   -0.00192100
 H                  3.55386800    3.90988600   -0.00210700
 N                 -3.60046100   -2.61249000   -0.01292500
 C                 -0.52814300    4.35882000    0.00091800
 H                 -1.03511500    5.31943700    0.00116600
 C                  0.85989500    4.31981400    0.00070400
 H                  1.42299200    5.24800600    0.00077600
 C                  3.40021400   -2.86697400   -0.01124100
 N                  4.61527200   -1.05203200   -0.01379300
 Eu                -0.07974700   -1.47433800    0.01457900

EuR1PhR4 3+ (PBE0/6-311G*-RECP)
C                 -0.77587800    1.90506700    0.00000300
 C                 -2.75609100    0.70346900    0.00151500
 C                 -3.52681600    1.87766600    0.00227700
 H                 -4.60940300    1.82670200    0.00339100
 C                  0.69240500    1.91315900   -0.00042700
 C                  1.37619000    3.16301700   -0.00030300
 C                  2.79288500    3.13488600   -0.00047900
 C                  3.44310800    1.93051400   -0.00025900
 H                  3.35274100    4.06540000   -0.00043800
 H                  4.52529500    1.89452600   -0.00003700
 N                  1.33315700    0.74722000   -0.00046600
 C                 -1.47624600    3.14034800    0.00062300
 C                 -3.34818400   -0.61643200    0.00206700
 C                 -4.66020400   -1.06182300    0.00314400
 H                 -5.61867900   -0.56410300    0.00417100
 H                 -5.27856300   -3.09270000    0.00389200
 C                  2.69224800    0.73836800    0.00006200
 C                  4.72648700   -0.83593800    0.00105600
 C                  4.80359400   -2.20896600    0.00407700
 H                  5.56351200   -0.15485800   -0.00186700
 H                  3.25979400   -3.63662100    0.01070400
 H                  5.64977200   -2.88166300    0.00468700
 C                  3.34686000   -0.55158100    0.00171100
 N                  2.62350200   -1.70081700    0.00578000
 N                 -2.55275200   -1.73127500    0.00078700
 N                 -1.39981600    0.72947800    0.00016000
 C                 -2.89017700    3.09330100    0.00166500
 H                 -3.46317200    4.01583000    0.00209600
 N                  3.53621700   -2.66411000    0.00671100
 C                  0.64342600    4.35889800   -0.00005900
 H                  1.16866800    5.30968400   -0.00014700
 C                 -0.75619100    4.34967700    0.00045800
 H                 -1.29412000    5.29347900    0.00086200
 N                 -3.27920300   -2.79695900    0.00259000
 N                 -4.54089200   -2.39573700    0.00304400
 Eu                 0.01171700   -1.48558800   -0.00413200

EuR1PhR5 3+ (PBE0/6-311G*-RECP)
C                 -0.74813500    1.89537600   -0.00012000
 C                 -2.72701800    0.69148500    0.00006700
 C                 -3.49641800    1.86682100   -0.00001500
 H                 -4.57864300    1.81543400    0.00004500
 C                  0.71921100    1.90312400   -0.00003400
 C                  1.40699800    3.15087800    0.00013500
 C                  2.82395400    3.11697900    0.00038300
 C                  3.46996800    1.90971300    0.00048200
 H                  3.38761800    4.04527600    0.00051500
 H                  4.55212100    1.86971500    0.00072400
 N                  1.35545000    0.73579500   -0.00002900
 C                 -1.44730100    3.13029600   -0.00014000
 C                 -3.35433700   -0.61479300    0.00040200
 C                 -4.71424300   -0.97601200    0.00076300
 H                 -5.61243000   -0.37583300    0.00077700
 H                 -3.33589400   -3.68583600    0.00121000
 C                  2.71441900    0.72091800    0.00026300
 C                  4.73233400   -0.87405100    0.00065500
 C                  4.79390300   -2.24825900    0.00075800
 H                  5.57681500   -0.20208600    0.00068100
 H                  3.23646800   -3.65889700    0.00060500
 H                  5.63262500   -2.93039600    0.00099300
 C                  3.35658700   -0.57449700    0.00037000
 N                  2.61907600   -1.71531300    0.00032100
 N                 -2.62944300   -1.75652600    0.00054900
 N                 -1.37202500    0.71856000   -0.00007600
 C                 -2.86082300    3.08369400   -0.00014800
 H                 -3.43509800    4.00552100   -0.00021300
 N                  3.52194900   -2.68909400    0.00053900
 C                  0.67617200    4.34744900    0.00007900
 H                  1.20137600    5.29833900    0.00018600
 C                 -0.72513900    4.33907500   -0.00009000
 H                 -1.26179100    5.28372100   -0.00015300
 N                 -3.55157000   -2.69647900    0.00094300
 N                 -4.79252600   -2.29758500    0.00114800
 Eu                 0.01364600   -1.47253400   -0.00082500

EuR1PhR6 3+ (PBE0/6-311G*-RECP)
C                  0.80731300    1.89528600   -0.00531600
 C                  2.76442000    0.66400800    0.04602900
 C                  3.55595100    1.81886100    0.06282000
 H                  4.63809000    1.76044400    0.09275100
 C                 -0.65866800    1.92079400   -0.01391400
 C                 -1.32499400    3.18013200   -0.01266600
 C                 -2.74229000    3.16851800   -0.00574300
 C                 -3.40635100    1.97234100    0.01566200
 H                 -3.29141600    4.10538700   -0.01069400
 H                 -4.48888400    1.94981600    0.03005900
 N                 -1.31201500    0.76151400   -0.00694500
 C                  1.52641300    3.11948900    0.00968000
 C                  3.28809400   -0.68863000    0.07723000
 H                  5.42155100   -0.61892500    0.17948300
 C                  4.46670800   -2.49995500    0.14968900
 H                  5.31672000   -3.16690300    0.19648900
 C                 -2.67032900    0.76939600    0.02162200
 C                 -4.72100100   -0.77894400    0.13485000
 C                 -4.81298300   -2.14968500    0.18311300
 H                 -5.54968900   -0.08782100    0.14884700
 H                 -3.28558900   -3.59614000    0.17068800
 H                 -5.66547000   -2.81198500    0.24092300
 C                 -3.33916300   -0.51103100    0.07050500
 N                 -2.62858600   -1.67045100    0.07770600
 N                  2.47959700   -1.74394700    0.04893900
 N                  1.41183000    0.71245200    0.00310300
 C                  2.93559100    3.04834600    0.03960900
 H                  3.52541700    3.96021100    0.04929500
 N                 -3.55085400   -2.62051200    0.14574100
 C                 -0.57516400    4.36739700   -0.01360900
 H                 -1.08912600    5.32425100   -0.01883700
 C                  0.82009700    4.34189000   -0.00162300
 H                  1.37044900    5.27839600    0.00263900
 N                  3.20642900   -2.86916600    0.09273300
 N                  4.55933500   -1.14665200    0.14120300
 Eu                -0.02450900   -1.49029600   -0.14518400

EuR1PhR7 3+ (PBE0/6-311G*-RECP)
C                 -0.74334300    1.89287500    0.00018400
 C                 -2.71054300    0.68482200   -0.00126100
 C                 -3.49658200    1.84690400   -0.00177400
 H                 -4.57744800    1.76294800   -0.00270300
 C                  0.72206900    1.90334800    0.00037200
 C                  1.40674700    3.15372700    0.00031500
 C                  2.82417500    3.12194000    0.00005000
 C                  3.47117700    1.91558600   -0.00063000
 H                  3.38666500    4.05090200    0.00018600
 H                  4.55333600    1.87689700   -0.00111900
 N                  1.35836900    0.73655800    0.00013900
 C                 -1.45106900    3.12079700   -0.00025400
 C                 -3.31713400   -0.63469000   -0.00229700
 H                 -5.66486100   -2.55420300   -0.00611300
 H                 -3.41853700   -3.80591300   -0.00400200
 C                  2.71712400    0.72473700   -0.00078300
 C                  4.73935600   -0.86406700   -0.00420800
 C                  4.80555400   -2.23746700   -0.00561000
 H                  5.58134300   -0.18904700   -0.00464900
 H                  3.25129700   -3.65252400   -0.00523300
 H                  5.64619900   -2.91709100   -0.00733100
 C                  3.36182200   -0.56882900   -0.00228000
 N                  2.62829500   -1.71215200   -0.00246000
 N                 -2.59962600   -1.80658000   -0.00197900
 N                 -1.36058400    0.71222700   -0.00002600
 C                 -2.86564500    3.06747000   -0.00110800
 H                 -3.44379500    3.98686200   -0.00140500
 N                  3.53423300   -2.68204100   -0.00446300
 C                  0.67087700    4.34627100    0.00036100
 H                  1.19169300    5.29951400    0.00050000
 C                 -0.73106000    4.33269500    0.00003800
 H                 -1.27042700    5.27580500   -0.00010100
 N                 -4.62206200   -0.81270700   -0.00396700
 C                 -3.54748000   -2.73247800   -0.00357900
 N                 -4.74349200   -2.13023400   -0.00475600
 Eu                 0.00416400   -1.48748400    0.00459300

EuR1PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.77368600    1.88962200    0.00408500
 C                 -2.73543200    0.66458500   -0.02490000
 C                 -3.52130300    1.82602800   -0.03231300
 H                 -4.60398200    1.77432400   -0.04821900
 C                  0.69280600    1.90975000    0.00706500
 C                  1.36663900    3.16609900    0.00482400
 C                  2.78436500    3.14639800   -0.00192700
 C                  3.44155500    1.94627300   -0.01533400
 H                  3.33872100    4.08024600   -0.00039000
 H                  4.52400700    1.91728100   -0.02595800
 N                  1.33895600    0.74825000    0.00255300
 C                 -1.48653800    3.11588900   -0.00322500
 C                 -3.28970100   -0.67570700   -0.04669700
 H                 -5.42183800   -0.47041300   -0.10997400
 H                 -3.24098000   -3.84481900   -0.07377700
 C                  2.69823200    0.74787700   -0.01674400
 C                  4.73723500   -0.81744700   -0.08525000
 C                  4.81832100   -2.18942200   -0.11235500
 H                  5.57176800   -0.13322300   -0.09524300
 H                  3.27956500   -3.62245100   -0.10200400
 H                  5.66584600   -2.85970700   -0.14698700
 C                  3.35633300   -0.53755000   -0.04572200
 N                  2.63576000   -1.69041600   -0.04772100
 N                 -2.55002000   -1.79621900   -0.03456700
 N                 -1.38383900    0.70739600   -0.00080800
 C                 -2.89718400    3.05183800   -0.01853700
 H                 -3.48343400    3.96606700   -0.02254700
 N                  3.55159100   -2.64854700   -0.08800500
 C                  0.62313600    4.35543400    0.00663900
 H                  1.13985600    5.31090000    0.00862600
 C                 -0.77474600    4.33476200    0.00227900
 H                 -1.32090800    5.27385500    0.00077000
 N                 -4.71700800   -2.35325700   -0.10458000
 N                 -4.58331600   -1.03783100   -0.08852600
 C                 -3.47065500   -2.78876500   -0.07111300
 Eu                 0.01730500   -1.48843900    0.09274000

EuR2PhR2 3+ (PBE0/6-311G*-RECP)
C                  0.73296900    1.90239600    0.00154800
 C                  2.72115100    0.70653000   -0.00687400
 C                  3.48144900    1.89575000   -0.00792400
 H                  4.56399600    1.85586800   -0.01208600
 C                 -0.73294800    1.90239900    0.00160500
 C                 -1.42389200    3.14440600    0.00002200
 C                 -2.84026000    3.10273900   -0.00340600
 C                 -3.48142800    1.89576500   -0.00759500
 H                 -3.40724100    4.02870900   -0.00385000
 H                 -4.56397600    1.85588900   -0.01166700
 N                 -1.36442500    0.72875000    0.00025900
 C                  1.42392000    3.14440200   -0.00005800
 C                  3.33814400   -0.59279800   -0.01485000
 C                  4.68901800   -0.91570600   -0.02930400
 H                  5.58334300   -0.31052900   -0.03641900
 H                  5.58528200   -2.82197500   -0.04583600
 H                  3.25860700   -3.80357400   -0.02590800
 C                 -2.72113600    0.70654100   -0.00668400
 C                 -4.68902900   -0.91567000   -0.02812300
 H                 -5.58336100   -0.31048600   -0.03350000
 H                 -3.25863200   -3.80354700   -0.02889900
 H                 -5.58532600   -2.82192000   -0.04504300
 C                 -3.33813700   -0.59278300   -0.01484000
 N                 -2.59653400   -1.76615000   -0.01366600
 N                  2.59653700   -1.76615700   -0.01174900
 N                  1.36444100    0.72874600    0.00022400
 C                  2.84028700    3.10272800   -0.00362900
 H                  3.40727200    4.02869500   -0.00400900
 C                  3.47433500   -2.74415900   -0.02422100
 C                 -3.47435700   -2.74413400   -0.02573900
 N                  4.74057200   -2.26277400   -0.03494100
 N                 -4.74059800   -2.26273300   -0.03479900
 C                  0.69728700    4.34628200    0.00103500
 H                  1.23012800    5.29253900    0.00103900
 C                 -0.69725400    4.34628400    0.00103600
 H                 -1.23009200    5.29254200    0.00095600
 Eu                -0.00001100   -1.46707700    0.03041100


EuR2PhR3 3+ (PBE0/6-311G*-RECP)
C                 -0.68104400    1.91057900   -0.00006000
 C                 -2.69585000    0.76053400    0.00005600
 C                 -3.42567200    1.96848900    0.00008600
 H                 -4.50890900    1.95538800    0.00017600
 C                  0.78291000    1.87784800   -0.00005600
 C                  1.50474500    3.10669700   -0.00005500
 C                  2.91733700    3.03083800   -0.00000600
 C                  3.53289700    1.80797300    0.00007500
 H                  3.50654600    3.94281400   -0.00001900
 H                  4.61545500    1.75591900    0.00012800
 N                  1.38698400    0.69288100   -0.00001300
 C                 -1.33903200    3.16679500   -0.00005700
 C                 -3.34806200   -0.52373800    0.00022000
 C                 -4.70488400   -0.81211100    0.00061900
 H                 -5.58403700   -0.18519700    0.00079000
 H                 -5.64928300   -2.69614200    0.00018100
 H                 -3.34897000   -3.73647800    0.00046600
 C                  2.74212600    0.64145100    0.00008500
 H                  5.40658700   -0.37289000    0.00049000
 H                  3.12504500   -3.87495100    0.00028300
 H                  5.69014500   -2.85755900    0.00084000
 C                  3.29700400   -0.68328800    0.00022800
 N                  2.56044500   -1.81126900    0.00022100
 N                 -2.63596400   -1.71559800    0.00022900
 N                 -1.34103000    0.74996000   -0.00003200
 C                 -2.75517400    3.15991800    0.00000200
 H                 -3.29995100    4.09910800    0.00001000
 C                 -3.53843200   -2.67210000    0.00045500
 C                  3.43140200   -2.83861600    0.00031900
 N                 -4.79057100   -2.15873100    0.00026000
 C                 -0.58226100    4.35489600   -0.00008800
 H                 -1.09616600    5.31160400   -0.00009900
 C                  0.80714500    4.32646300   -0.00009000
 H                  1.36200800    5.25973700   -0.00010400
 N                  4.62033100   -1.00888800    0.00042100
 C                  4.73600800   -2.34973700    0.00062300
 Eu                -0.04614000   -1.47995500   -0.00039500

EuR2PhR4 3+ (PBE0/6-311G*-RECP)
C                 -0.71811100    1.90386200   -0.00014100
 C                 -2.70839900    0.71238800    0.00030400
 C                 -3.47318300    1.90334100    0.00023900
 H                 -4.55570000    1.86171200    0.00046000
 C                  0.74818100    1.91066400   -0.00004200
 C                  1.42951600    3.14979700    0.00007100
 C                  2.84062000    3.12185600    0.00055800
 C                  3.49426300    1.91328600    0.00096400
 H                  3.40233000    4.05120600    0.00068000
 H                  4.57744900    1.87759100    0.00139800
 N                  1.38851700    0.73872900    0.00023800
 C                 -1.41702100    3.15280900   -0.00017400
 C                 -3.32726600   -0.57923300    0.00096300
 C                 -4.68983000   -0.89301700    0.00242500
 H                 -5.57864600   -0.27894200    0.00343800
 H                 -5.60141600   -2.78766500    0.00401100
 H                 -3.27910300   -3.78957000    0.00136300
 C                  2.74103600    0.72962300    0.00077400
 C                  4.67464700   -1.00585800    0.00191000
 H                  5.62469000   -0.49280800    0.00229900
 H                  5.32766200   -3.02721800    0.00279900
 C                  3.35776600   -0.58392300    0.00113200
 N                  2.58160600   -1.71027400    0.00071900
 N                 -2.59906900   -1.75934200    0.00045000
 N                 -1.34847200    0.73269300   -0.00014600
 C                 -2.83523600    3.10889500   -0.00010100
 H                 -3.40203300    4.03493200   -0.00025500
 C                 -3.48447200   -2.72760000    0.00159600
 N                 -4.75186100   -2.23407600    0.00284700
 N                  4.57803900   -2.34384600    0.00217100
 C                 -0.70041800    4.35530700   -0.00033300
 H                 -1.23665900    5.29941300   -0.00059400
 C                  0.69182400    4.35767100   -0.00010100
 H                  1.22395400    5.30465400    0.00007100
 N                  3.32610900   -2.76594000    0.00156900
 Eu                 0.02428400   -1.48949400   -0.00207700

EuR2PhR5 3+ (PBE0/6-311G*-RECP)
C                  0.74286700    1.89471600   -0.00006300
 C                  2.72875600    0.69643200    0.00019700
 C                  3.49760500    1.88454800    0.00037800
 H                  4.58006300    1.83925300    0.00063300
 C                 -0.72185800    1.90096800   -0.00009400
 C                 -1.40344300    3.13874900   -0.00007600
 C                 -2.81410100    3.10924200    0.00002900
 C                 -3.46531700    1.89855300    0.00018300
 H                 -3.37838100    4.03711900    0.00003800
 H                 -4.54810500    1.86118900    0.00036000
 N                 -1.36074300    0.72699900   -0.00005100
 C                  1.44497300    3.14179500    0.00004600
 C                  3.33558100   -0.60008100    0.00033600
 C                  4.69358100   -0.93007600    0.00060800
 H                  5.58947000   -0.32618400    0.00067500
 H                  5.58249300   -2.83578700    0.00092200
 H                  3.25030300   -3.81015200    0.00070700
 C                 -2.71178900    0.71461300    0.00014500
 C                 -4.72304900   -0.92691700    0.00063800
 H                 -5.61224300   -0.31385200    0.00064200
 H                 -3.38589600   -3.65752400    0.00103500
 C                 -3.36015000   -0.58630800    0.00039100
 N                 -2.65244100   -1.73674800    0.00051300
 N                  2.59214300   -1.77171800    0.00032100
 N                  1.36903400    0.72210400   -0.00005400
 C                  2.86342700    3.09267800    0.00025900
 H                  3.43374400    4.01662500    0.00037800
 C                  3.46693100   -2.75045600    0.00061300
 N                  4.73945000   -2.27199800    0.00074400
 C                  0.72917500    4.34446500   -0.00003200
 H                  1.26499900    5.28887700    0.00000300
 C                 -0.66428900    4.34683600   -0.00010900
 H                 -1.19602000    5.29414300   -0.00015600
 N                 -3.58842000   -2.66598700    0.00082200
 N                 -4.82138700   -2.24824600    0.00086300
 Eu                -0.02154400   -1.47449400   -0.00076300

EuR2PhR6 3+ (PBE0/6-311G*-RECP)
C                  0.77763400    1.90275300    0.00827600
 C                  2.74741800    0.69358300   -0.06232000
 C                  3.52179300    1.85886000   -0.08323800
 H                  4.60427000    1.81582800   -0.12428500
 C                 -0.68731700    1.91227500    0.01872300
 C                 -1.36916100    3.16990300    0.01637000
 C                 -2.78746700    3.14233200    0.00566300
 C                 -3.43854900    1.94372400   -0.02242200
 H                 -3.34445900    4.07427800    0.01148700
 H                 -4.52141700    1.91516500   -0.04137900
 N                 -1.32877200    0.74726700    0.01112600
 C                  1.47768700    3.13235500   -0.00920800
 C                  3.29553000   -0.65342800   -0.10472100
 H                  5.42511700   -0.53814800   -0.22539200
 H                  5.37332900   -3.08843400   -0.25123600
 C                 -2.68763800    0.74278500   -0.02771200
 C                 -4.68499600   -0.83684500   -0.18105700
 H                 -5.56521700   -0.21121800   -0.21445400
 H                 -3.30677800   -3.74879200   -0.20640300
 H                 -5.61478300   -2.71726000   -0.31077100
 C                 -3.31949300   -0.54049500   -0.08799800
 N                 -2.60604500   -1.72930000   -0.08857800
 N                  2.50982900   -1.72177100   -0.07469000
 N                  1.39856600    0.72442300   -0.00578000
 C                  2.88462800    3.08090300   -0.04976700
 H                  3.46268200    4.00013900   -0.06151000
 C                 -3.50018500   -2.68480400   -0.17892600
 N                 -4.76098700   -2.17477200   -0.23713200
 C                  0.75334100    4.35224100    0.00620900
 H                  1.29710300    5.29250200    0.00147700
 C                 -0.63516300    4.36505200    0.02006900
 H                 -1.16093100    5.31498800    0.02724800
 N                  3.26091400   -2.83530200   -0.12783900
 C                  4.50965800   -2.44057400   -0.19400300
 N                  4.57498500   -1.08390700   -0.18165200
 Eu                 0.01373600   -1.49903600    0.18862500

EuR2PhR7 3+ (PBE0/6-311G*-RECP)
C                 -0.74271600    1.89545600   -0.00004000
 C                 -2.72981600    0.70297000   -0.00003300
 C                 -3.49569700    1.89400500   -0.00001900
 H                 -4.57824800    1.85151600   -0.00000400
 C                  0.71976600    1.89722800   -0.00003000
 C                  1.41124400    3.12799800    0.00002700
 C                  2.82305000    3.09068200    0.00006200
 C                  3.46856500    1.87594200    0.00005000
 H                  3.39187600    4.01576800    0.00010700
 H                  4.55033000    1.80501000    0.00008700
 N                  1.35105800    0.71881500   -0.00005500
 C                 -1.44014500    3.14574900   -0.00000900
 C                 -3.34118100   -0.59131100   -0.00000200
 C                 -4.70132900   -0.91428800   -0.00001100
 H                 -5.59391200   -0.30561600   -0.00006400
 H                 -5.60008400   -2.81510700    0.00006100
 H                 -3.27209200   -3.80093900    0.00017800
 C                  2.69725200    0.70523100   -0.00000800
 H                  3.46702400   -3.77847700    0.00010800
 H                  5.69592600   -2.49816100   -0.00000900
 C                  3.32486000   -0.60863300   -0.00000400
 N                  2.62282900   -1.78930900    0.00004600
 N                 -2.60382600   -1.76653500    0.00006000
 N                 -1.37077600    0.72399800   -0.00005700
 C                 -2.85884500    3.10061000   -0.00000700
 H                 -3.42689600    4.02590800    0.00001400
 C                 -3.48345400   -2.74021900    0.00011300
 C                  3.58339400   -2.70375800    0.00006300
 N                 -4.75431800   -2.25571400    0.00005500
 N                  4.76931600   -2.08714000    0.00000500
 C                 -0.71775000    4.34431200    0.00002300
 H                 -1.24853000    5.29151400    0.00004100
 C                  0.67585500    4.34008700    0.00004200
 H                  1.21154300    5.28515200    0.00007200
 N                  4.62988100   -0.76856600   -0.00004000
 Eu                 0.02754900   -1.49012300   -0.00003200


EuR2PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.71800600    1.90101900    0.00001000
 C                 -2.71442900    0.72406000   -0.00026200
 C                 -3.47062200    1.92175300   -0.00027400
 H                 -4.55352600    1.88852000   -0.00044100
 C                  0.74657100    1.89536900    0.00010300
 C                  1.44135400    3.12589700    0.00000800
 C                  2.84966000    3.08075200   -0.00003100
 C                  3.49051700    1.86195000    0.00004900
 H                  3.42469400    4.00196300   -0.00021200
 H                  4.57390200    1.82500100   -0.00004000
 N                  1.37297100    0.71668400    0.00021400
 C                 -1.40590600    3.15664500    0.00007200
 C                 -3.33991800   -0.56271900   -0.00014100
 C                 -4.70730800   -0.86832100   -0.00029400
 H                 -5.59191400   -0.24783800   -0.00109100
 H                 -5.63071800   -2.75599200   -0.00107700
 H                 -3.31457200   -3.77275100    0.00158900
 C                  2.72132800    0.69066900    0.00022300
 H                  5.42753200   -0.39907900    0.00106800
 H                  3.30947600   -3.81296800   -0.00116400
 C                  3.30113100   -0.64391200    0.00012000
 N                  2.58199900   -1.77527600   -0.00105800
 N                 -2.61971200   -1.74736000    0.00089300
 N                 -1.35458200    0.73428400   -0.00011800
 C                 -2.82432900    3.12321000   -0.00005000
 H                 -3.38502200    4.05297300    0.00008300
 C                 -3.51183900   -2.70912900    0.00084100
 C                  3.52299400   -2.75366400   -0.00071800
 N                 -4.77757100   -2.20724800   -0.00033300
 C                 -0.67692300    4.35358000    0.00009700
 H                 -1.20521100    5.30217400    0.00014900
 C                  0.71255100    4.34398700   -0.00000200
 H                  1.25404900    5.28566300   -0.00008400
 N                  4.75830200   -2.29782200    0.00024300
 N                  4.59975100   -0.98144600    0.00026900
 Eu                 0.02003600   -1.49694100    0.00003100


EuR3PhR3 3+ (PBE0/6-311G*-RECP)
C                  0.00000600    0.73162000   -1.88876200
 C                  0.00002700    2.71739500   -0.69634200
 C                  0.00007500    3.47887100   -1.88177600
 H                  0.00010300    4.56241700   -1.85610300
 C                 -0.00000600   -0.73162000   -1.88876200
 C                 -0.00003200   -1.42099400   -3.13229100
 C                 -0.00007400   -2.83420200   -3.09027700
 C                 -0.00007500   -3.47887100   -1.88177600
 H                 -0.00010500   -3.40224000   -4.01559100
 H                 -0.00010300   -4.56241700   -1.85610300
 N                  0.00000600   -1.36344000   -0.71605400
 C                  0.00003200    1.42099400   -3.13229100
 C                 -0.00000600    3.30601900    0.61650000
 H                 -0.00000700    5.40593700    0.25604400
 H                  0.00039400    5.74888600    2.73375900
 H                 -0.00033300    3.20996600    3.81202300
 C                 -0.00002700   -2.71739500   -0.69634200
 H                  0.00000700   -5.40593700    0.25604400
 H                  0.00033300   -3.20996600    3.81202300
 H                 -0.00039400   -5.74888600    2.73375900
 C                  0.00000600   -3.30601900    0.61650000
 N                  0.00018200   -2.59627400    1.76073800
 N                 -0.00018200    2.59627400    1.76073800
 N                 -0.00000600    1.36344000   -0.71605400
 C                  0.00007400    2.83420200   -3.09027700
 H                  0.00010500    3.40224000   -4.01559100
 C                 -0.00023500    3.49254500    2.76904200
 C                  0.00023500   -3.49254500    2.76904200
 C                  0.00019300    4.78259000    2.24976000
 C                 -0.00019300   -4.78259000    2.24976000
 N                 -0.00003500    4.63488100    0.91019700
 N                  0.00003500   -4.63488100    0.91019700
 C                  0.00002100    0.69263700   -4.33883800
 C                 -0.00002100   -0.69263700   -4.33883800
 H                  0.00003700    1.22851500   -5.28318600
 H                 -0.00003700   -1.22851500   -5.28318600
 Eu                 0.00000000    0.00000000    1.49291400

EuR3PhR4 3+ (PBE0/6-311G*-RECP)
C                  0.76556000    1.87928000    0.01179600
 C                  2.72659700    0.64695400   -0.02722200
 C                  3.52020800    1.81500500   -0.02518700
 H                  4.60275500    1.76277400   -0.04047200
 C                 -0.69713100    1.91791300    0.00720300
 C                 -1.34810900    3.17161300   -0.00349000
 C                 -2.75913500    3.17530700   -0.02985700
 C                 -3.43979200    1.98239400   -0.05413600
 H                 -3.29966600    4.11708000   -0.03618800
 H                 -4.52319600    1.97158200   -0.08192400
 N                 -1.36489000    0.75874200   -0.00245600
 C                  1.49296700    3.11325400    0.00932000
 C                  3.28514900   -0.67009800   -0.07191600
 H                  5.39533600   -0.34633500   -0.15954500
 H                  5.69149500   -2.82698200   -0.23199200
 H                  3.12965400   -3.86301300   -0.14338500
 C                 -2.71436300    0.78086400   -0.04236700
 H                 -5.62257400   -0.37976900   -0.17911300
 H                 -5.37818000   -2.92004700   -0.19755700
 C                 -3.36098500   -0.51884700   -0.07780900
 N                 -2.60919900   -1.66131100   -0.05789700
 N                  2.55536900   -1.80723500   -0.06764900
 N                  1.36976400    0.69554600    0.00376000
 C                  2.90664500    3.03643900   -0.00212300
 H                  3.49548400    3.94861100    0.00151500
 C                  3.42704900   -2.82355500   -0.13020800
 C                  4.73618100   -2.32296700   -0.17581300
 N                  4.61313300   -0.98793400   -0.13711100
 C                  0.80312400    4.33495900    0.01427000
 C                 -0.58260400    4.36559900    0.00728700
 H                  1.36167400    5.26579700    0.01863700
 H                 -1.09651900    5.32250700    0.00608400
 N                 -3.37467200   -2.70172100   -0.10355600
 C                 -4.68429900   -0.91269300   -0.14167500
 N                 -4.61524900   -2.25293500   -0.15449200
 Eu                -0.06727700   -1.49496500    0.14398900


EuR3PhR5 3+ (PBE0/6-311G*-RECP)
C                  0.78921500    1.86960200    0.00022600
 C                  2.74880600    0.63453700   -0.00093200
 C                  3.54403700    1.80128200   -0.00101200
 H                  4.62663900    1.74719500   -0.00155300
 C                 -0.67256700    1.90622700    0.00021100
 C                 -1.32488900    3.15825700    0.00003100
 C                 -2.73573000    3.16005900   -0.00052000
 C                 -3.41394200    1.96490800   -0.00116900
 H                 -3.27902200    4.10033400   -0.00058800
 H                 -4.49731600    1.95212300   -0.00181300
 N                 -1.33883700    0.74484000   -0.00006100
 C                  1.51787300    3.10306700    0.00007800
 C                  3.30044200   -0.68546900   -0.00208800
 H                  5.41477400   -0.37987900   -0.00449100
 H                  5.69248700   -2.86391900   -0.00627300
 H                  3.12183000   -3.87838200   -0.00389300
 C                 -2.68774300    0.76323000   -0.00102000
 H                 -5.61251400   -0.19611900   -0.00472600
 H                 -3.46784900   -3.59297300   -0.00399200
 C                 -3.36811000   -0.52241600   -0.00214900
 N                 -2.68824200   -1.68955000   -0.00195400
 N                  2.56055400   -1.81662600   -0.00191000
 N                  1.39156400    0.68574500    0.00001200
 C                  2.93179800    3.02403600   -0.00037200
 H                  3.52209400    3.93534000   -0.00036700
 C                  3.42593600   -2.84081600   -0.00355500
 C                  4.73999800   -2.35132300   -0.00480100
 N                  4.62668200   -1.01500100   -0.00383100
 C                  0.82755300    4.32403200    0.00028800
 C                 -0.55935900    4.35318500    0.00026000
 H                  1.38471200    5.25578500    0.00035300
 H                 -1.07402400    5.30978900    0.00030000
 N                 -4.86823600   -2.14911600   -0.00482800
 N                 -3.64646800   -2.59686800   -0.00357700
 C                 -4.73820600   -0.83019800   -0.00396500
 Eu                -0.06415200   -1.48454700    0.00417500

EuR3PhR6 3+ (PBE0/6-311G*-RECP)
C                  0.73510600    1.88731900   -0.00029900
 C                  2.71169500    0.68224200    0.00054200
 C                  3.48781400    1.86255900    0.00060400
 H                  4.57116100    1.82685800    0.00118700
 C                 -0.72767400    1.90901100   -0.00021100
 C                 -1.39739900    3.15460200    0.00008100
 C                 -2.80558600    3.13744600    0.00063300
 C                 -3.47286400    1.93222200    0.00111500
 H                 -3.36079800    4.07067300    0.00079900
 H                 -4.55683600    1.91543500    0.00162100
 N                 -1.37878500    0.74388100   -0.00002500
 C                  1.44318200    3.13156100   -0.00022100
 C                  3.29577500   -0.62490000    0.00158900
 H                  5.40181800   -0.25870900    0.00181200
 H                  5.75077800   -2.73315100    0.00415500
 H                  3.20762200   -3.82155600    0.00454500
 C                 -2.72736900    0.74749700    0.00086500
 H                 -5.44434100   -0.40687900    0.00461100
 H                 -5.46833100   -2.95820100    0.00470300
 C                 -3.31616900   -0.58400500    0.00159700
 N                 -2.56160300   -1.67427000    0.00080300
 N                  2.58958200   -1.77779900    0.00239600
 N                  1.35456700    0.71055900   -0.00010800
 C                  2.85706900    3.07565300    0.00009000
 H                  3.43316700    3.99591100    0.00010700
 C                  3.48266900   -2.77573000    0.00348200
 C                  4.78395700   -2.24792100    0.00338400
 C                 -4.58410400   -2.33606900    0.00350300
 N                  4.63220600   -0.91587300    0.00236100
 C                  0.73537600    4.34650400   -0.00027900
 C                 -0.64639800    4.36135100   -0.00014500
 H                  1.28377500    5.28334700   -0.00030700
 H                 -1.17316000    5.31113900   -0.00013700
 N                 -3.34666200   -2.76697200    0.00186500
 N                 -4.60928000   -0.97710900    0.00339500
 Eu                -0.05611900   -1.51710900   -0.00310900

EuR3PhR7 3+ (PBE0/6-311G*-RECP)
C                 -0.78739500    1.87086900   -0.00003700
 C                 -2.74937700    0.64295700   -0.00006400
 C                 -3.54072900    1.81318000   -0.00018900
 H                 -4.62350500    1.76284900   -0.00024800
 C                  0.67239400    1.90196600   -0.00007000
 C                  1.33568200    3.14702700   -0.00036500
 C                  2.74793000    3.14029200   -0.00054200
 C                  3.41983200    1.94072900   -0.00047600
 H                  3.29626800    4.07762300   -0.00074400
 H                  4.50291300    1.89375100   -0.00065100
 N                  1.33044100    0.73568700    0.00010000
 C                 -1.51049100    3.10787100   -0.00023800
 C                 -3.30672300   -0.67457200   -0.00016200
 H                 -5.41924300   -0.35581800   -0.00055500
 H                 -5.71214900   -2.83820800   -0.00067800
 H                 -3.14710900   -3.86768200   -0.00037400
 C                  2.67479400    0.75225400   -0.00016000
 H                  3.54842900   -3.71352800    0.00062600
 H                  5.74690500   -2.38249900   -0.00086000
 C                  3.33384800   -0.54693500   -0.00015400
 N                  2.65897300   -1.74370000   -0.00001500
 N                 -2.57368600   -1.81007000   -0.00009900
 N                 -1.39262700    0.68852500    0.00009800
 C                 -2.92477100    3.03399800   -0.00025500
 H                 -3.51213400    3.94714600   -0.00035500
 C                 -3.44526400   -2.82842300   -0.00033100
 C                  3.64043300   -2.63643900    0.00030400
 C                 -4.75665800   -2.33140300   -0.00048100
 N                 -4.63540000   -0.99594200   -0.00042800
 C                 -0.81255300    4.32447800   -0.00041500
 C                  0.57474300    4.34626600   -0.00049100
 H                 -1.36420000    5.25946600   -0.00052500
 H                  1.09394800    5.30040700   -0.00065300
 N                  4.64160900   -0.67721400   -0.00067500
 N                  4.81111900   -1.99283700   -0.00054400
 Eu                 0.06845600   -1.50062400    0.00064600


EuR3PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.76440600    1.87673300   -0.00841500
 C                 -2.73399200    0.66160300    0.02156500
 C                 -3.51705000    1.83757100    0.02215200
 H                 -4.60015800    1.79554200    0.03483100
 C                  0.69719100    1.90144000   -0.00645900
 C                  1.36325900    3.14661600    0.00013500
 C                  2.77229100    3.13182200    0.01716900
 C                  3.43966100    1.92819900    0.03477200
 H                  3.32689000    4.06543500    0.02018000
 H                  4.52348200    1.91534700    0.05260400
 N                  1.35061300    0.73498000    0.00085500
 C                 -1.47874500    3.11810400   -0.00521400
 C                 -3.30343100   -0.65038500    0.05352100
 H                 -5.41287600   -0.30951400    0.12081700
 H                 -5.73013000   -2.78795300    0.17178000
 H                 -3.17527000   -3.84510200    0.10211300
 C                  2.69684300    0.73923600    0.02847900
 H                  5.42520900   -0.29043100    0.13112100
 H                  3.38464800   -3.75100700    0.09250800
 C                  3.30708300   -0.58237300    0.05639900
 N                  2.61300300   -1.72936300    0.04365000
 N                 -2.58222600   -1.79447900    0.04815800
 N                 -1.37712300    0.69789600   -0.00247500
 C                 -2.89285900    3.05416300    0.00518700
 H                 -3.47409000    3.97123300    0.00389400
 C                 -3.46216100   -2.80249200    0.09404700
 C                  3.57527400   -2.68735100    0.08797800
 C                 -4.77029300   -2.29058900    0.12990600
 N                 -4.63559500   -0.95767300    0.10277900
 N                  4.61095800   -0.89096300    0.10614100
 C                 -0.77485100    4.33409700   -0.00972200
 C                  0.60838300    4.35150900   -0.00690100
 H                 -1.32454300    5.27022300   -0.01201100
 H                  1.13264100    5.30277700   -0.00709700
 N                  4.79847700   -2.20444500    0.12691200
 Eu                 0.06197200   -1.50374000   -0.10762700






EuR4PhR4 3+ (PBE0/6-311G*-RECP)
C                 -0.73523100    1.91802100    0.00006100
 C                 -2.73012500    0.74029000    0.00084400
 C                 -3.48928100    1.92348900    0.00117000
 H                 -4.57226100    1.88307500    0.00195600
 C                  0.73522300    1.91802200   -0.00024300
 C                  1.42562300    3.16274700   -0.00029100
 C                  2.84122800    3.13089200   -0.00077900
 C                  3.48927200    1.92349600   -0.00114900
 H                  3.40357300    4.05994500   -0.00085300
 H                  4.57225300    1.88308400   -0.00183600
 N                  1.37132100    0.74941000   -0.00046800
 C                 -1.42563300    3.16274500    0.00004800
 C                 -3.34493400   -0.56694500    0.00099900
 H                 -5.61559000   -0.46511800   -0.00023200
 H                 -5.33117400   -3.00021900   -0.00025200
 C                  2.73012000    0.74029500   -0.00076100
 H                  5.61558800   -0.46509400    0.00093200
 H                  5.33119000   -3.00019700    0.00127900
 C                  3.34493300   -0.56693800   -0.00066300
 N                  2.57505300   -1.69976400   -0.00113000
 N                 -2.57504600   -1.69976500    0.00151200
 N                 -1.37132700    0.74940800    0.00040300
 C                 -2.84123900    3.13088700    0.00061700
 H                 -3.40358500    4.05993900    0.00063200
 N                 -3.32461700   -2.74782200    0.00092400
 N                  3.32463200   -2.74781500   -0.00027100
 N                 -4.57875300   -2.31887800    0.00013000
 N                  4.57876500   -2.31886200    0.00066800
 C                 -4.66827600   -0.98396000    0.00022000
 C                  4.66827800   -0.98394400    0.00039600
 C                 -0.70001900    4.36521300   -0.00005400
 H                 -1.23149500    5.31262200    0.00013900
 C                  0.70000600    4.36521400   -0.00030600
 H                  1.23148000    5.31262400   -0.00057300
 Eu                 0.00000200   -1.51776500   -0.00022600

EuR4PhR5 3+ (PBE0/6-311G*-RECP)
C                 -0.70580400    1.90796800   -0.00719300
 C                 -2.69901400    0.72669700    0.01658500
 C                 -3.45705200    1.91083700    0.01499300
 H                 -4.53961000    1.86997300    0.02579400
 C                  0.76366100    1.90738300   -0.00397300
 C                  1.45874300    3.14943300    0.00299100
 C                  2.87455200    3.11045400    0.01867000
 C                  3.51761300    1.89954500    0.03311800
 H                  3.44157100    4.03674500    0.02241500
 H                  4.60037200    1.85444900    0.04980400
 N                  1.39438200    0.73722000    0.00094600
 C                 -1.39510000    3.15197400   -0.00581600
 C                 -3.34661700   -0.56771800    0.04508200
 H                 -5.60117400   -0.28690200    0.09576300
 C                  2.75296400    0.72035800    0.02573100
 H                  5.62196800   -0.53161600    0.11176600
 H                  5.29312900   -3.06158300    0.12155100
 C                  3.35104700   -0.59403100    0.04729200
 N                  2.56127200   -1.71346400    0.03390300
 N                 -2.64471400   -1.72418900    0.04799700
 N                 -1.34163500    0.73803500   -0.00220700
 C                 -2.81030100    3.11980400    0.00105900
 H                 -3.37445300    4.04786200   -0.00075200
 N                  3.29217700   -2.77455500    0.06187200
 N                  4.55270400   -2.36743600    0.09471600
 C                 -4.71421400   -0.90353300    0.08394100
 C                  4.66598600   -1.03400800    0.08768200
 C                 -0.66680900    4.35370400   -0.00826100
 H                 -1.19681000    5.30207300   -0.01112500
 C                  0.73508100    4.35267900   -0.00336500
 H                  1.26664600    5.30013600   -0.00216500
 N                 -3.58318600   -2.64474000    0.08647900
 H                 -3.38509800   -3.63823600    0.10160200
 N                 -4.81708800   -2.22258500    0.10960000
 Eu                 0.00043900   -1.49778100   -0.08950800

EuR4PhR6 3+ (PBE0/6-311G*-RECP)
C                 -0.76579900    1.90895000   -0.01332600
 C                 -2.73610100    0.69923500    0.05585900
 C                 -3.51746900    1.86251500    0.07060200
 H                 -4.59978200    1.81372100    0.10888800
 C                  0.70152100    1.92687200   -0.01797100
 C                  1.37470900    3.18035700   -0.01052200
 C                  2.79104300    3.16409300    0.00888000
 C                  3.45214500    1.96439500    0.03810600
 H                  3.34332000    4.09916000    0.00866600
 H                  4.53528100    1.93656600    0.06421500
 N                  1.34997700    0.76426600   -0.00965200
 C                 -1.47590700    3.14178900   -0.00099300
 C                 -3.28058900   -0.64223000    0.10262900
 H                 -5.41308500   -0.53177900    0.21238100
 C                  2.70692800    0.77102200    0.03625000
 H                  5.59806300   -0.40871000    0.23520300
 H                  5.33082000   -2.94527300    0.28851200
 C                  3.33243200   -0.52932200    0.09378000
 N                  2.57153500   -1.66901400    0.07843100
 N                 -2.49267200   -1.71517600    0.08274400
 N                 -1.38155900    0.73191800    0.00211500
 C                 -2.88701400    3.08436800    0.03445800
 H                 -3.46728700    4.00236700    0.04089200
 N                  3.32689000   -2.71005600    0.15411000
 N                  4.57531200   -2.27037700    0.22160300
 C                  4.65618000   -0.93539400    0.18789200
 C                 -0.76423900    4.35761600   -0.01342200
 H                 -1.30846100    5.29765200   -0.01125500
 C                  0.63159100    4.37418500   -0.01969500
 H                  1.15170300    5.32780300   -0.02586300
 N                 -3.23990700   -2.82346200    0.13634100
 H                 -5.35636500   -3.08034900    0.25082200
 C                 -4.49453800   -2.42925500    0.19446300
 N                 -4.56083700   -1.07579400    0.17560100
 Eu                 0.01262300   -1.51638800   -0.18322900

EuR4PhR7 3+ (PBE0/6-311G*-RECP)
C                 -0.70216000    1.90555300    0.00012700
 C                 -2.68334200    0.71947300   -0.00035400
 C                 -3.45873500    1.89006400   -0.00042000
 H                 -4.54028500    1.81574100   -0.00069800
 C                  0.76552300    1.90864100    0.00010600
 C                  1.45695300    3.15353300    0.00006300
 C                  2.87336800    3.11734700   -0.00017000
 C                  3.51817200    1.90764800   -0.00049200
 H                  3.43875800    4.04459600   -0.00015000
 H                  4.60110100    1.86446000   -0.00071600
 N                  1.39701400    0.73946300   -0.00007600
 C                 -1.40067600    3.14240000    0.00004100
 C                 -3.31086200   -0.58887900   -0.00089400
 C                  2.75555900    0.72612200   -0.00049000
 H                  5.62911400   -0.51027000   -0.00266800
 H                  5.31567400   -3.04211400   -0.00294200
 C                  3.35754900   -0.58618900   -0.00097600
 N                  2.57377700   -1.71029800   -0.00051800
 N                 -2.61872900   -1.77528800   -0.00051900
 N                 -1.33084300    0.73144400    0.00007200
 C                 -2.81704000    3.10303300   -0.00015800
 H                 -3.38537800    4.02852500   -0.00017100
 N                  3.31149500   -2.76642900   -0.00132100
 N                  4.57106300   -2.35221900   -0.00221200
 C                  4.67603600   -1.01860500   -0.00205000
 C                 -0.67520400    4.34737400    0.00014300
 H                 -1.20827700    5.29404300    0.00019100
 C                  0.72762900    4.35229400    0.00013900
 H                  1.25418300    5.30249700    0.00012700
 H                 -5.69865100   -2.45974900   -0.00310200
 C                 -3.58408800   -2.68151200   -0.00149600
 H                 -3.47637200   -3.75746400   -0.00151100
 N                 -4.76880400   -2.05413900   -0.00230700
 N                 -4.62088400   -0.74095500   -0.00203600
 Eu                -0.00826300   -1.51541400    0.00183100

EuR4PhR8 3+ (PBE0/6-311G*-RECP)
C                  0.73454800    1.90125200   -0.00025500
 C                  2.71078300    0.69792600    0.00064800
 C                  3.48612200    1.86788800    0.00088200
 H                  4.56929100    1.82626700    0.00153900
 C                 -0.73416300    1.91522500   -0.00024400
 C                 -1.41330200    3.16692300    0.00000200
 C                 -2.83012900    3.14495200    0.00034200
 C                 -3.48684100    1.94251700    0.00067100
 H                 -3.38591600    4.07799700    0.00046700
 H                 -4.57019000    1.91040400    0.00106900
 N                 -1.37749300    0.75189700   -0.00021400
 C                  1.43885900    3.13633500   -0.00010600
 C                  3.28822500   -0.63047500    0.00135500
 C                 -2.73663500    0.75243000    0.00051200
 H                 -5.62706800   -0.44424500    0.00301200
 H                 -5.34833000   -2.97987800    0.00391100
 C                 -3.35570300   -0.55105300    0.00129000
 N                 -2.58801500   -1.68645600    0.00131600
 N                  2.57416500   -1.76793900    0.00177100
 N                  1.35609100    0.72512600   -0.00005400
 C                  2.85146100    3.08606800    0.00037200
 H                  3.42800500    4.00645300    0.00047400
 N                 -3.34022100   -2.73185300    0.00222300
 N                 -4.59427100   -2.29993300    0.00306700
 C                 -4.68092100   -0.96556900    0.00248700
 C                  0.72296800    4.34891200   -0.00015700
 H                  1.26380000    5.29105100   -0.00006100
 C                 -0.67568200    4.36195400   -0.00015900
 H                 -1.19763900    5.31468300   -0.00022500
 C                  3.51454400   -2.73940200    0.00263100
 H                  3.30813100   -3.80040500    0.00323000
 N                  4.59198700   -0.96557600    0.00211300
 H                  5.41899600   -0.38082100    0.00200500
 N                  4.75404200   -2.27557300    0.00280000
 Eu                -0.00790300   -1.51880400   -0.00266900



EuR5PhR5 3+ (PBE0/6-311G*-RECP)
C                 -0.73412400    1.89721400    0.00030700
 C                 -2.72271100    0.70806300   -0.00095100
 C                 -3.48557800    1.88864500   -0.00102300
 H                 -4.56811300    1.84346900   -0.00166300
 C                  0.73431000    1.89717700    0.00026200
 C                  1.42803700    3.13868800   -0.00014700
 C                  2.84340700    3.10059000   -0.00073300
 C                  3.48576800    1.88848400   -0.00130900
 H                  3.41155900    4.02628800   -0.00095300
 H                  4.56830100    1.84324700   -0.00207600
 N                  1.36539600    0.72557300    0.00014100
 C                 -1.42779000    3.13875300    0.00002900
 C                 -3.35798300   -0.59212700   -0.00242400
 H                 -5.61590100   -0.33885400   -0.00424900
 C                  2.72284100    0.70794300   -0.00103700
 H                  5.61595600   -0.33932500   -0.00373200
 C                  3.35800700   -0.59229300   -0.00238800
 N                  2.64069400   -1.73986100   -0.00307400
 N                 -2.64082700   -1.73980800   -0.00295900
 N                 -1.36526600    0.72563500    0.00013400
 C                 -2.84316000    3.10072200   -0.00040500
 H                 -3.41127100    4.02644500   -0.00047800
 N                 -4.80786200   -2.26546200   -0.00543500
 N                  4.80768200   -2.26582300   -0.00521500
 C                 -4.72134100   -0.94468900   -0.00403500
 C                  4.72131900   -0.94504500   -0.00373400
 C                 -0.70151700    4.34140400    0.00005300
 H                 -1.23185200    5.28969000    0.00002000
 C                  0.70182400    4.34137100   -0.00005700
 H                  1.23220100    5.28963300   -0.00019900
 N                 -3.56924000   -2.67253200   -0.00474300
 H                 -3.36100300   -3.66402700   -0.00595100
 N                  3.56899400   -2.67270000   -0.00467900
 H                  3.36063200   -3.66416700   -0.00598100
 Eu                -0.00008500   -1.48296700    0.00494600

EuR5PhR6 3+ (PBE0/6-311G*-RECP)
C                  0.67468200    1.91475000   -0.00013000
 C                  2.68196400    0.75945300    0.00089400
 C                  3.42459500    1.95508700    0.00050400
 H                  4.50765000    1.92801000    0.00081600
 C                 -0.79393700    1.89783800    0.00003400
 C                 -1.50584200    3.13007600    0.00014600
 C                 -2.91744800    3.07138100    0.00086800
 C                 -3.54769800    1.84819000    0.00160700
 H                 -3.49883300    3.98878700    0.00094300
 H                 -4.63067100    1.79820500    0.00230600
 N                 -1.40822700    0.72172100    0.00039000
 C                  1.34713700    3.16920900   -0.00035900
 C                  3.34939800   -0.52372200    0.00213900
 H                  5.60068700   -0.20569300    0.00355900
 C                 -2.76483400    0.68648600    0.00134200
 H                 -5.44082300   -0.56487300    0.00520000
 C                 -3.30426500   -0.65755800    0.00223300
 N                 -2.50764300   -1.72390800    0.00133700
 N                  2.66758600   -1.69318900    0.00240500
 N                  1.32412900    0.75235500    0.00029500
 C                  2.76333700    3.15509100   -0.00019900
 H                  3.31558900    4.09026200   -0.00048100
 N                  4.84955900   -2.15390300    0.00474800
 C                  4.72409900   -0.83720000    0.00340300
 C                  0.60362300    4.36192100   -0.00062700
 H                  1.12323700    5.31600100   -0.00093300
 C                 -0.79486300    4.34554500   -0.00033900
 H                 -1.33841400    5.28614300   -0.00041200
 N                  3.62183000   -2.59679300    0.00431200
 H                  3.44116300   -3.59402300    0.00522700
 N                 -3.24703200   -2.83834600    0.00222600
 N                 -4.58304000   -1.10171600    0.00405500
 C                 -4.50677200   -2.45447200    0.00423600
 H                 -5.36501100   -3.11283800    0.00550900
 Eu                 0.01057500   -1.51469800   -0.00404200




EuR5PhR7 3+ (PBE0/6-311G*-RECP)
C                  0.73763000    1.89787400   -0.00010200
 C                  2.72607900    0.71233200   -0.00009600
 C                  3.48748500    1.89478600   -0.00039600
 H                  4.57003200    1.85087000   -0.00057100
 C                 -0.72913600    1.89517400    0.00002400
 C                 -1.43157100    3.12977300    0.00027300
 C                 -2.84814900    3.08490200    0.00049900
 C                 -3.48587000    1.86909300    0.00047100
 H                 -3.42015700    4.00821200    0.00071800
 H                 -4.56726100    1.79117800    0.00065400
 N                 -1.35359500    0.71989200   -0.00005900
 C                  1.42820200    3.14198300   -0.00020600
 C                  3.36355300   -0.58631300    0.00026600
 H                  5.62094500   -0.32591600    0.00060500
 C                 -2.70601700    0.70191200    0.00017900
 C                 -3.32009100   -0.61197000    0.00018200
 N                 -2.61154200   -1.78952600    0.00005600
 N                  2.65013200   -1.73629000    0.00048700
 N                  1.36873200    0.72696600   -0.00006200
 C                  2.84409300    3.10601300   -0.00043700
 H                  3.41105000    4.03239700   -0.00061400
 N                  4.81960900   -2.25494700    0.00094800
 C                  4.72854500   -0.93485700    0.00059300
 C                  0.69688000    4.34042000   -0.00004600
 H                  1.22270800    5.29116400   -0.00012300
 C                 -0.70754600    4.33526500    0.00023800
 H                 -1.24044700    5.28213000    0.00041800
 N                  3.58127100   -2.66525700    0.00083600
 H                  3.37557200   -3.65715700    0.00106900
 C                 -3.56577500   -2.70838400    0.00021400
 H                 -3.44536400   -3.78298600    0.00020200
 N                 -4.75816500   -2.09636100    0.00035700
 H                 -5.68287000   -2.51413000    0.00048300
 N                 -4.62740700   -0.78130800    0.00035900
 Eu                -0.01011600   -1.49914200   -0.00052800

EuR5PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.70734300    1.90434800   -0.00040900
 C                 -2.70766800    0.73766400   -0.00006200
 C                 -3.45751500    1.92838500   -0.00043500
 H                 -4.54045600    1.89493600   -0.00035500
 C                  0.76108700    1.89136900   -0.00027600
 C                  1.46863300    3.12455600   -0.00032200
 C                  2.88140900    3.06976700   -0.00006900
 C                  3.51275200    1.84903500    0.00028500
 H                  3.46110900    3.98825700   -0.00013200
 H                  4.59584800    1.80389600    0.00053900
 N                  1.37878800    0.71469500   -0.00008000
 C                 -1.38650000    3.15508000   -0.00066000
 C                 -3.36147700   -0.55205500    0.00049100
 H                 -5.61630600   -0.26123700   -0.00305800
 C                  2.73348900    0.68205000    0.00028600
 H                  5.43157700   -0.42926500    0.00249000
 C                  3.29813500   -0.65144200    0.00074700
 N                  2.56861400   -1.77979700    0.00016700
 N                 -2.66455000   -1.71259100    0.00273600
 N                 -1.34961000    0.73938900   -0.00015700
 C                 -2.80294000    3.13265700   -0.00072200
 H                 -3.36075200    4.06458600   -0.00089500
 N                 -4.84109600   -2.20045400    0.00068600
 C                 -4.73205700   -0.88206700   -0.00096000
 C                 -0.64751800    4.34966200   -0.00079700
 H                 -1.16892600    5.30286000   -0.00099000
 C                  0.75329600    4.33700300   -0.00064600
 H                  1.29323800    5.27978900   -0.00077700
 N                 -3.60821600   -2.62789400    0.00288200
 H                 -3.41631900   -3.62292700    0.00520600
 N                  4.59695800   -1.00358100    0.00159000
 C                  3.49674500   -2.76342500    0.00082300
 H                  3.27798300   -3.82196200    0.00059300
 N                  4.74195100   -2.31537700    0.00166900
 Eu                -0.00527000   -1.50436800   -0.00083700

EuR6PhR6 3+ (PBE0/6-311G*-RECP)
C                  0.73305200    1.91688200    0.01671500
 C                  2.71797100    0.73211300   -0.03599500
 C                  3.48366800    1.90684600   -0.04274200
 H                  4.56691800    1.87221000   -0.06955200
 C                 -0.73216300    1.91705600    0.01528400
 C                 -1.42425600    3.15986500    0.00484100
 C                 -2.83652500    3.12079300   -0.02390000
 C                 -3.48270800    1.90777400   -0.05550500
 H                 -3.40491300    4.04619400   -0.02839000
 H                 -4.56581700    1.87336900   -0.08761900
 N                 -1.36274100    0.74658700    0.00228000
 C                  1.42521900    3.15937900    0.00677900
 C                  3.28173900   -0.60105600   -0.08515700
 H                  5.41143200   -0.46117000   -0.20851600
 H                  5.38913300   -3.01047600   -0.26074000
 C                 -2.71718700    0.73278000   -0.04480200
 H                 -5.41192500   -0.45948100   -0.19407800
 H                 -5.39159600   -3.00898200   -0.23570400
 C                 -3.28127300   -0.60014100   -0.08958500
 N                 -2.50824400   -1.68562700   -0.07187700
 N                  2.50856200   -1.68588400   -0.06317100
 N                  1.36345800    0.74618600    0.00851100
 C                  2.83748900    3.12012600   -0.01551200
 H                  3.40609200    4.04540400   -0.01843200
 N                  3.26988500   -2.78312800   -0.13139900
 N                 -3.27109100   -2.78249000   -0.12615600
 C                  4.51888900   -2.37129800   -0.19615300
 C                 -4.52046900   -2.37006800   -0.18086100
 N                  4.56686600   -1.01701400   -0.16775300
 N                 -4.56728400   -1.01565300   -0.15966200
 C                 -0.69509500    4.36725400    0.01452300
 H                 -1.22856800    5.31336700    0.01433500
 C                  0.69609600    4.36704400    0.01641700
 H                  1.22982100    5.31301700    0.02018900
 Eu                -0.00036700   -1.52343500    0.16201600

EuR6PhR7 3+ (PBE0/6-311G*-RECP)
C                 -0.79565300    1.89983300    0.00919200
 C                 -2.76430200    0.68917300   -0.03608700
 C                 -3.54678000    1.85204600   -0.04589600
 H                 -4.62947900    1.80249400   -0.07091200
 C                  0.67013000    1.91321100    0.01299900
 C                  1.35255900    3.15956300    0.00804700
 C                  2.77004400    3.13597000   -0.00549200
 C                  3.42471800    1.93098900   -0.02487600
 H                  3.32799300    4.06775400   -0.00631900
 H                  4.50692900    1.86924500   -0.04463600
 N                  1.31099800    0.74543500    0.00733900
 C                 -1.50489000    3.13378900    0.00038500
 C                 -3.30120000   -0.65512900   -0.06727300
 H                 -5.43618200   -0.56095300   -0.14139300
 H                 -5.36105000   -3.10896700   -0.16827200
 C                  2.66305000    0.74972900   -0.02164400
 H                  5.71239700   -2.39140700   -0.19024900
 C                  3.30469600   -0.55008300   -0.05953400
 N                  2.62681300   -1.74547000   -0.05810200
 N                 -2.50450800   -1.72222200   -0.05361300
 N                 -1.40886800    0.72359100   -0.00054500
 C                 -2.91688000    3.07514400   -0.02279900
 H                 -3.49836800    3.99243600   -0.02746400
 N                 -3.24422200   -2.83555200   -0.09058900
 C                 -4.50338700   -2.45107300   -0.13000700
 N                 -4.57943600   -1.09870100   -0.11670900
 C                  0.61125500    4.35563300    0.01292600
 H                  1.13358900    5.30822800    0.01615800
 C                 -0.78806700    4.34508700    0.00841100
 H                 -1.32646300    5.28857000    0.00660500
 C                  3.60157800   -2.63936800   -0.11452600
 H                  3.50653300   -3.71644400   -0.13367300
 N                  4.77856200   -1.99696300   -0.14604900
 N                  4.61615600   -0.68679100   -0.11225700
 Eu                 0.01959400   -1.52224300    0.12080700

EuR6PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.76397800    1.90668400   -0.01141500
 C                 -2.74296800    0.71249800    0.05022400
 C                 -3.51463600    1.88320700    0.06555800
 H                 -4.59751800    1.84334500    0.10016000
 C                  0.70164700    1.90964400   -0.01773500
 C                  1.39002600    3.15307300   -0.01191400
 C                  2.80365800    3.11711800    0.00231700
 C                  3.45065000    1.90604200    0.02693800
 H                  3.37095700    4.04322700    0.00089300
 H                  4.53411000    1.87613500    0.04654200
 N                  1.33483900    0.73873300   -0.01102500
 C                 -1.46194700    3.14658100    0.00188800
 C                 -3.29357000   -0.62561100    0.08947200
 H                 -5.42649000   -0.51156200    0.18891700
 H                 -5.37510600   -3.06029200    0.21891800
 C                  2.68816600    0.72631400    0.02677400
 C                  3.27619000   -0.59602700    0.07909200
 N                  2.57044100   -1.74010000    0.07190300
 N                 -2.50718600   -1.70160700    0.06862200
 N                 -1.38792500    0.73479100    0.00175700
 C                 -2.87440000    3.09997200    0.03486400
 H                 -3.44768900    4.02239900    0.04251200
 N                 -3.25646000   -2.80721900    0.11538400
 C                 -4.51177800   -2.41039700    0.16909800
 N                 -4.57485100   -1.05719800    0.15460400
 C                  0.65735600    4.35753300   -0.01752600
 H                  1.18761300    5.30557900   -0.02325300
 C                 -0.73689900    4.35483200   -0.00911400
 H                 -1.27121500    5.30057600   -0.00529400
 C                  3.51555600   -2.70331900    0.15430300
 H                  3.31688000   -3.76571500    0.17387200
 N                  4.57984300   -0.92066100    0.16125700
 H                  5.40159200   -0.32912300    0.19341800
 N                  4.75016500   -2.22861200    0.20935000
 Eu                 0.00391100   -1.51556100   -0.16089800

EuR7PhR7 3+ (PBE0/6-311G*-RECP)
C                  0.73258000    1.89617600   -0.00013200
 C                  2.70880800    0.70577800   -0.00021800
 C                  3.48754600    1.87465900   -0.00031200
 H                  4.56893400    1.79764500   -0.00042400
 C                 -0.73258000    1.89617600   -0.00005000
 C                 -1.43217000    3.13304400   -0.00006300
 C                 -2.84927800    3.08988800    0.00010900
 C                 -3.48754600    1.87466000    0.00029400
 H                 -3.42047700    4.01364800    0.00003500
 H                 -4.56893400    1.79764600    0.00049200
 N                 -1.35652600    0.72131300    0.00006000
 C                  1.43217000    3.13304400   -0.00018100
 C                  3.32461700   -0.60703600   -0.00007700
 C                 -2.70880800    0.70577800    0.00025100
 C                 -3.32461700   -0.60703600    0.00033600
 N                 -2.61970800   -1.78659400   -0.00023600
 N                  2.61970900   -1.78659400    0.00058100
 N                  1.35652600    0.72131200   -0.00013500
 C                  2.84927800    3.08988800   -0.00028500
 H                  3.42047700    4.01364800   -0.00026600
 C                  3.57623500   -2.70200800    0.00036200
 H                  3.45885200   -3.77689900    0.00068000
 C                 -3.57623400   -2.70200800    0.00017000
 H                 -3.45885200   -3.77689900   -0.00007600
 C                  0.70280600    4.33419900   -0.00025700
 H                  1.23117200    5.28357500   -0.00048900
 C                 -0.70280600    4.33419900   -0.00008900
 H                 -1.23117200    5.28357500    0.00007600
 N                  4.63319800   -0.77249500   -0.00013500
 N                 -4.63319800   -0.77249500    0.00066000
 N                 -4.76769500   -2.08669200    0.00101400
 H                 -5.69343400   -2.50178200    0.00162400
 N                  4.76769500   -2.08669200   -0.00034200
 H                  5.69343500   -2.50178200   -0.00077100
 Eu                 0.00000000   -1.51406700   -0.00016400

EuR7PhR8 3+ (PBE0/6-311G*-RECP)
C                  0.70226600    1.90238100    0.00038000
 C                  2.69017800    0.73024200   -0.00078900
 C                  3.45775900    1.90732500   -0.00115300
 H                  4.53988600    1.84042600   -0.00193500
 C                 -0.76413900    1.89245100    0.00039300
 C                 -1.46863900    3.12793900    0.00009000
 C                 -2.88192200    3.07477700   -0.00038600
 C                 -3.51404800    1.85464200   -0.00091100
 H                 -3.46079900    3.99374000   -0.00055000
 H                 -4.59716800    1.81067100   -0.00148300
 N                 -1.38156300    0.71617600    0.00021900
 C                  1.39073000    3.14589400    0.00007600
 C                  3.32200400   -0.57416700   -0.00181200
 C                 -2.73604300    0.68594100   -0.00075500
 C                 -3.30219600   -0.64646500   -0.00189000
 N                 -2.57626800   -1.77713100   -0.00266200
 N                  2.63404400   -1.76369300   -0.00110200
 N                  1.33722100    0.73313200    0.00022200
 C                  2.80846700    3.11577100   -0.00054100
 H                  3.37078200    4.04497900   -0.00066600
 C                  3.60289300   -2.66569900   -0.00268900
 H                  3.50056900   -3.74225100   -0.00246700
 C                 -3.50722800   -2.75691000   -0.00432700
 H                 -3.29178500   -3.81608000   -0.00548000
 C                  0.65405900    4.34341000    0.00014800
 H                  1.17814300    5.29515800    0.00003100
 C                 -0.74783100    4.33616500    0.00018000
 H                 -1.28305100    5.28159000    0.00015000
 N                  4.63348700   -0.72177200   -0.00416300
 N                  4.78604400   -2.03315600   -0.00480600
 H                  5.71762100   -2.43561500   -0.00654400
 N                 -4.75199200   -2.30545000   -0.00462200
 N                 -4.60277300   -0.99459700   -0.00312200
 H                 -5.43521000   -0.41733300   -0.00268100
 Eu                 0.01548800   -1.51860300    0.00390100

EuR8PhR8 3+ (PBE0/6-311G*-RECP)
C                 -0.73352300    1.89858700    0.00002500
 C                 -2.71699900    0.70963400    0.00054800
 C                 -3.48384200    1.88642500    0.00050000
 H                 -4.56736300    1.85269300    0.00065200
 C                  0.73352300    1.89858700   -0.00015500
 C                  1.42686600    3.14034600   -0.00008000
 C                  2.84078400    3.09989500   -0.00017700
 C                  3.48384200    1.88642500   -0.00034800
 H                  3.41099900    4.02426300   -0.00004300
 H                  4.56736300    1.85269300   -0.00038000
 N                  1.36209000    0.72727900   -0.00035800
 C                 -1.42686500    3.14034600   -0.00005300
 C                 -3.29921400   -0.61516500    0.00078600
 H                 -5.43009500   -0.35990200    0.00373000
 C                  2.71700000    0.70963300   -0.00038000
 H                  5.43009600   -0.35990200   -0.00269100
 C                  3.29921400   -0.61516600   -0.00033600
 N                  2.58788500   -1.75578300    0.00103900
 N                 -2.58788600   -1.75578300   -0.00064300
 N                 -1.36209000    0.72727900    0.00032000
 C                 -2.84078400    3.09989500    0.00015200
 H                 -3.41099800    4.02426400   -0.00000800
 N                 -4.60451200   -0.94723000    0.00193600
 N                  4.60451300   -0.94723000   -0.00107100
 C                 -3.53049700   -2.72366400   -0.00034100
 H                 -3.32887400   -3.78565900   -0.00142400
 C                  3.53049700   -2.72366500    0.00115300
 H                  3.32887400   -3.78565900    0.00233100
 N                 -4.77002100   -2.25543200    0.00123600
 N                  4.77002100   -2.25543200   -0.00013300
 C                 -0.69860600    4.34547500   -0.00011500
 H                 -1.23006900    5.29298600   -0.00011800
 C                  0.69860700    4.34547400   -0.00010200
 H                  1.23007000    5.29298600   -0.00013800
 Eu                 0.00000000   -1.51921900   -0.00039200
