32
[Ru(OAc)L]+
44      -0.234083000     -0.225936000     -0.461220000
8       -1.888648000     -1.137544000     -0.438343000
6       -2.987895000     -0.880759000      0.329791000
8       -3.012014000      0.047014000      1.102049000
6       -4.086045000     -1.858039000      0.082540000
1       -3.741074000     -2.869357000      0.321181000
1       -4.354627000     -1.857571000     -0.978614000
1       -4.954657000     -1.605631000      0.691422000
6        0.599602000      1.730554000     -0.988000000
6        1.720393000      0.883770000     -0.844478000
6       -0.374573000      1.887026000      0.047662000
1        2.380690000      0.737411000     -1.695036000
6        1.876444000      0.086239000      0.305819000
6       -0.205212000      1.102380000      1.227910000
1       -0.995149000      1.090848000      1.974475000
6        0.887847000      0.202030000      1.331352000
1        0.938585000     -0.475754000      2.182485000
1        0.428857000      2.227439000     -1.941357000
6       -1.575668000      2.744005000     -0.135462000
1       -2.449052000      2.291448000      0.344706000
1       -1.399796000      3.721522000      0.332227000
1       -1.788860000      2.915019000     -1.194663000
6        2.987729000     -0.916588000      0.463100000
1        2.592463000     -1.731708000      1.088796000
6        3.478612000     -1.507774000     -0.850252000
1        3.998737000     -0.761693000     -1.463923000
1        4.200067000     -2.305002000     -0.648593000
1        2.664570000     -1.941892000     -1.443855000
6        4.129364000     -0.234975000      1.225646000
1        4.937399000     -0.951279000      1.404521000
1        4.540013000      0.597673000      0.640894000
1        3.803187000      0.156722000      2.195594000
7
AcO-
8       -0.682326000      1.164656000      0.000055000
8       -0.809492000     -1.099509000     -0.000071000
6       -0.219223000      0.002103000      0.000013000
6        1.342891000     -0.062170000     -0.000007000
1        1.718645000     -1.093568000     -0.000616000
1        1.736902000      0.465827000      0.879749000
1        1.736983000      0.466963000     -0.879039000
10
2
6       -0.603897000      0.001574000      0.000340000
6        0.604098000      0.003395000     -0.000567000
6       -2.057704000     -0.001208000      0.000055000
1       -2.460369000      1.003106000      0.175561000
1       -2.456809000     -0.352014000     -0.958701000
1       -2.458337000     -0.656707000      0.781855000
6        2.057667000     -0.001386000     -0.000078000
1        2.454468000     -1.022854000      0.030612000
1        2.461761000      0.481468000     -0.897240000
1        2.458296000      0.532757000      0.869403000
37
1a
6       -4.677013000      2.234258000     -0.285458000
6       -4.976551000      0.972134000      0.153048000
6       -3.977098000     -0.027508000      0.230811000
6       -2.634624000      0.276267000     -0.158202000
6       -2.361581000      1.595436000     -0.606174000
6       -3.354838000      2.541232000     -0.664375000
6       -4.303811000     -1.323706000      0.693305000
6       -3.345012000     -2.296300000      0.789452000
6       -2.019265000     -2.004690000      0.425794000
6       -1.649250000     -0.761437000     -0.048111000
6       -0.225141000     -0.553531000     -0.450189000
7        0.636948000     -1.508549000      0.081865000
8        0.151964000      0.365774000     -1.169617000
16       2.131425000     -1.351082000     -0.388399000
8        2.561063000     -1.640353000     -1.759804000
6        2.948597000     -2.486852000      0.712067000
6        2.822002000      0.226644000      0.107232000
6        3.777562000      0.807869000     -0.714461000
6        4.353882000      2.009598000     -0.316748000
6        3.969967000      2.605616000      0.879616000
6        3.003759000      2.010883000      1.687777000
6        2.419615000      0.811293000      1.303198000
1       -5.451051000      2.995888000     -0.342763000
1       -5.990500000      0.711113000      0.453297000
1       -1.351983000      1.837482000     -0.915315000
1       -3.116178000      3.543830000     -1.012330000
1       -5.336864000     -1.528594000      0.971730000
1       -3.599634000     -3.291826000      1.144232000
1       -1.255916000     -2.772818000      0.505206000
1        4.018010000     -2.448225000      0.491210000
1        2.742503000     -2.205163000      1.746503000
1        2.542493000     -3.477914000      0.496935000
1        4.041340000      0.324827000     -1.651783000
1        5.099935000      2.484597000     -0.948377000
1        4.421794000      3.546549000      1.183709000
1        2.698061000      2.488070000      2.615116000
1        1.645136000      0.342728000      1.907834000
69
B
6        3.283404000     -4.440523000     -0.781815000
6        3.741925000     -3.298661000     -1.399042000
6        2.895568000     -2.183301000     -1.569200000
6        1.557119000     -2.254461000     -1.089798000
6        1.107573000     -3.438170000     -0.466158000
6        1.958077000     -4.511039000     -0.315613000
6        3.361959000     -0.989176000     -2.201740000
6        2.555136000      0.098383000     -2.353952000
6        1.212632000      0.063716000     -1.870787000
6        0.724557000     -1.095726000     -1.239080000
6       -0.740875000     -1.119436000     -0.938218000
7       -1.064171000      0.044646000     -0.198146000
8       -1.511844000     -1.989199000     -1.262739000
16      -2.354017000      0.871156000     -0.710396000
8       -2.298274000      1.422220000     -2.062444000
6       -2.564944000      2.151430000      0.503678000
6       -3.800509000     -0.147776000     -0.548108000
6       -4.676696000     -0.185315000     -1.625882000
6       -5.837898000     -0.942143000     -1.502615000
6       -6.098854000     -1.633796000     -0.325015000
6       -5.203465000     -1.583834000      0.743101000
6       -4.037951000     -0.839701000      0.637422000
1        3.944308000     -5.294496000     -0.659509000
1        4.764100000     -3.241234000     -1.768438000
1        0.074969000     -3.505996000     -0.131734000
1        1.600992000     -5.422469000      0.156492000
1        4.384146000     -0.973257000     -2.577161000
1        2.906748000      1.003373000     -2.840978000
1        0.507092000      0.825258000     -2.199589000
1       -3.478897000      2.681290000      0.221835000
1       -2.666630000      1.700268000      1.494077000
1       -1.681673000      2.792353000      0.418853000
1       -4.446474000      0.361122000     -2.536479000
1       -6.537017000     -0.991032000     -2.332477000
1       -7.007681000     -2.223046000     -0.236836000
1       -5.412947000     -2.134520000      1.655946000
1       -3.319014000     -0.810920000      1.454208000
44       0.893635000      0.779996000      0.407574000
8        0.167557000      2.469913000     -0.550337000
6        0.928518000      3.263425000     -1.268004000
8        2.135714000      3.137492000     -1.400157000
6        0.127828000      4.354691000     -1.935474000
1       -0.350020000      4.988017000     -1.180096000
1       -0.673330000      3.906498000     -2.534077000
1        0.773931000      4.967209000     -2.566034000
6        2.664505000     -0.188992000      1.266294000
6        1.545991000     -0.689814000      1.972784000
6        2.969189000      1.201417000      1.189594000
1        1.349597000     -1.758943000      1.959856000
6        0.615139000      0.205938000      2.553521000
6        2.029256000      2.085839000      1.768615000
1        2.148912000      3.154072000      1.599952000
6        0.862678000      1.608161000      2.424383000
1        0.128861000      2.316585000      2.805032000
1        3.292596000     -0.890254000      0.716725000
6        4.176872000      1.688726000      0.466926000
1        3.993716000      2.669207000      0.022057000
1        5.025267000      1.753103000      1.159119000
1        4.448019000      0.996811000     -0.337770000
6       -0.618437000     -0.267224000      3.276645000
1       -1.423747000      0.444938000      3.028581000
6       -1.065920000     -1.670329000      2.893809000
1       -0.344511000     -2.426138000      3.229201000
1       -2.013760000     -1.905733000      3.390763000
1       -1.209933000     -1.781472000      1.811480000
6       -0.351545000     -0.176645000      4.782974000
1       -1.240703000     -0.480876000      5.344981000
1        0.469954000     -0.846435000      5.066581000
1       -0.083528000      0.838478000      5.095482000
69
TSBC
8       -1.087475000     -1.259616000     -2.935452000
1       -1.364794000     -0.441959000     -1.875126000
6       -1.678571000      0.493034000     -1.077476000
6       -3.046574000      0.850595000     -1.227195000
6       -3.436500000      2.159683000     -1.155150000
6       -2.487698000      3.195152000     -0.950626000
6       -2.898452000      4.543422000     -0.850594000
6       -1.975655000      5.543334000     -0.673478000
6       -0.600878000      5.234673000     -0.593229000
1       -2.300288000      6.578013000     -0.600124000
1       -3.960128000      4.772502000     -0.920403000
6       -1.093669000      2.879529000     -0.869901000
6       -0.164597000      3.937272000     -0.691438000
6       -0.728199000      1.506644000     -0.934751000
1        0.895664000      3.707828000     -0.657276000
1        0.121271000      6.036266000     -0.461466000
1       -4.483418000      2.436116000     -1.272362000
1       -3.776748000      0.068290000     -1.435485000
44      -1.049499000     -1.165700000      0.278275000
6        0.685995000      1.054767000     -0.913340000
7        0.814072000     -0.228836000     -0.327580000
8        1.631917000      1.671083000     -1.363213000
16       2.187492000     -0.979070000     -0.763161000
8        2.359764000     -1.338193000     -2.168902000
6        2.208921000     -2.451380000      0.231967000
6        3.593060000     -0.061709000     -0.175972000
1        3.140312000     -2.960462000     -0.032338000
1        2.208012000     -2.179521000      1.289704000
1        1.335823000     -3.045243000     -0.056848000
6        4.724440000     -0.050137000     -0.981079000
6        3.547588000      0.559804000      1.069182000
6        5.858205000      0.603855000     -0.508652000
1        4.705400000     -0.527523000     -1.957393000
6        5.839783000      1.224435000      0.736051000
1        6.755272000      0.631711000     -1.120658000
6        4.688871000      1.206231000      1.522485000
1        6.728874000      1.735027000      1.096381000
1        4.679733000      1.706130000      2.487203000
1        2.630065000      0.563498000      1.656505000
8       -0.528578000     -2.571169000     -1.215607000
6       -3.010686000     -1.031436000      1.273723000
6       -0.886849000     -0.625992000      2.447608000
6       -1.480156000     -2.881018000      1.614212000
6       -0.640497000     -2.329292000     -2.471653000
6       -0.151635000     -3.392179000     -3.405251000
1       -0.245974000     -4.384874000     -2.960710000
1        0.909520000     -3.192731000     -3.595557000
1       -0.684387000     -3.336508000     -4.356075000
6       -2.110755000     -0.146248000      1.937589000
6       -2.715600000     -2.398018000      1.078279000
1       -3.906499000     -0.619288000      0.815925000
1       -2.340147000      0.917093000      1.964003000
6       -3.608541000     -3.292047000      0.284244000
6       -0.600570000     -2.022626000      2.293317000
6        0.098854000      0.243827000      3.183083000
1       -1.179684000     -3.906058000      1.402872000
1        0.352019000     -2.406553000      2.654597000
1       -3.019695000     -3.971258000     -0.341040000
1       -4.235290000     -3.901386000      0.946218000
1       -4.270366000     -2.711890000     -0.366938000
1        1.091919000     -0.214602000      3.033556000
6        0.157770000      1.686882000      2.704688000
6       -0.234528000      0.173883000      4.676138000
1       -0.790607000      2.213618000      2.869843000
1        0.922314000      2.232290000      3.268917000
1        0.405764000      1.760858000      1.639569000
1        0.503078000      0.734567000      5.259699000
1       -1.221224000      0.614859000      4.866795000
1       -0.248475000     -0.857554000      5.046263000
69
C
8       -1.447397000      0.562601000     -2.916446000
1       -1.664234000      0.686219000     -1.965855000
6       -1.813183000      0.417160000      0.067574000
6       -3.227593000      0.509937000      0.083838000
6       -3.847998000      1.724228000      0.248360000
6       -3.111227000      2.920075000      0.409591000
6       -3.776478000      4.153879000      0.597873000
6       -3.062752000      5.316556000      0.730616000
6       -1.655373000      5.278722000      0.676404000
1       -3.574792000      6.264142000      0.875304000
1       -4.864406000      4.158090000      0.633768000
6       -1.685224000      2.877710000      0.352854000
6       -0.977598000      4.096469000      0.490870000
6       -1.066035000      1.594736000      0.160447000
1        0.104392000      4.090045000      0.439731000
1       -1.092474000      6.203073000      0.781555000
1       -4.936036000      1.784361000      0.253254000
1       -3.839476000     -0.378684000     -0.059426000
44      -0.818112000     -1.384584000      0.001319000
6        0.372534000      1.455545000     -0.098866000
7        0.758210000      0.082132000     -0.217400000
8        1.183742000      2.345879000     -0.282274000
16       2.077936000     -0.057917000     -1.141095000
8        1.984163000      0.362509000     -2.541502000
6        2.466137000     -1.790717000     -1.104409000
6        3.496460000      0.677351000     -0.362518000
1        3.370135000     -1.891111000     -1.712407000
1        2.657670000     -2.106510000     -0.077083000
1        1.628116000     -2.329185000     -1.556137000
6        4.490741000      1.169766000     -1.198917000
6        3.609656000      0.677964000      1.024189000
6        5.649380000      1.671324000     -0.614654000
1        4.346957000      1.174229000     -2.276302000
6        5.790306000      1.671824000      0.769255000
1        6.439857000      2.068493000     -1.245128000
6        4.774110000      1.180865000      1.587581000
1        6.697830000      2.067372000      1.217627000
1        4.885469000      1.202929000      2.668057000
1        2.786635000      0.328226000      1.645403000
8       -0.711200000     -1.438820000     -2.209632000
6       -2.460106000     -2.472066000      0.999712000
6       -0.231249000     -2.120041000      1.989899000
6       -0.535341000     -3.707783000      0.131260000
6       -0.897329000     -0.606690000     -3.107795000
6       -0.484465000     -0.859790000     -4.512194000
1       -0.313592000     -1.924376000     -4.674032000
1        0.450939000     -0.314707000     -4.683498000
1       -1.229497000     -0.470728000     -5.209910000
6       -1.622692000     -1.851897000      1.968607000
6       -1.915042000     -3.323935000      0.015127000
1       -3.512532000     -2.206791000      0.949302000
1       -2.043091000     -1.103291000      2.635851000
6       -2.756377000     -3.859637000     -1.095851000
6        0.272279000     -3.133994000      1.102818000
6        0.706788000     -1.496747000      2.990660000
1       -0.110824000     -4.383100000     -0.609521000
1        1.329512000     -3.390179000      1.151214000
1       -2.178564000     -3.935394000     -2.022571000
1       -3.126683000     -4.861841000     -0.847921000
1       -3.622162000     -3.215550000     -1.281523000
1        1.690311000     -1.430272000      2.493417000
6        0.298760000     -0.101513000      3.439384000
6        0.843906000     -2.439531000      4.188757000
1       -0.619872000     -0.124300000      4.038998000
1        1.078057000      0.327899000      4.078410000
1        0.137254000      0.576097000      2.592551000
1        1.559760000     -2.037808000      4.913789000
1       -0.122069000     -2.551729000      4.697624000
1        1.185433000     -3.438166000      3.892752000
8
AcOH
8        0.763117000     -1.046132000     -0.000001000
1        1.703889000     -0.811349000      0.000028000
8        0.651605000      1.192477000      0.000003000
6        0.092231000      0.124496000     -0.000016000
6       -1.386783000     -0.100082000     -0.000008000
1       -1.903728000      0.859573000     -0.000657000
1       -1.675371000     -0.682122000      0.880486000
1       -1.675260000     -0.683336000     -0.879730000
61
D
6        2.741079000      5.458732000      0.094690000
6        1.385397000      5.381447000      0.288351000
6        0.716713000      4.138572000      0.206028000
6        1.463248000      2.952600000     -0.076905000
6        2.862795000      3.065707000     -0.272934000
6        3.478611000      4.290473000     -0.189157000
6       -0.684446000      4.054471000      0.393411000
6       -1.352850000      2.859036000      0.302418000
6       -0.638730000      1.660978000      0.062758000
6        0.741655000      1.722425000     -0.120900000
6        1.398653000      0.429676000     -0.380510000
7        0.578614000     -0.647303000      0.112119000
8        2.458730000      0.224092000     -0.932471000
16       1.171233000     -2.135549000     -0.150507000
8        0.968352000     -2.752510000     -1.463886000
6        0.337882000     -3.094413000      1.096329000
6        2.871546000     -2.238293000      0.353331000
6        3.731946000     -2.944028000     -0.477722000
6        5.054448000     -3.094113000     -0.072951000
6        5.484046000     -2.542720000      1.129278000
6        4.601577000     -1.832773000      1.942745000
6        3.277081000     -1.673897000      1.560580000
1        3.249744000      6.416993000      0.159814000
1        0.801990000      6.273492000      0.509136000
1        3.439356000      2.175970000     -0.501622000
1        4.552466000      4.361433000     -0.343238000
1       -1.230317000      4.972787000      0.607863000
1       -2.431839000      2.840374000      0.447505000
1        0.719910000     -4.114995000      1.007970000
1        0.554450000     -2.674511000      2.080871000
1       -0.733560000     -3.057696000      0.888511000
1        3.371495000     -3.350645000     -1.418982000
1        5.749660000     -3.639971000     -0.704349000
1        6.519389000     -2.662195000      1.436911000
1        4.948515000     -1.398763000      2.876250000
1        2.585138000     -1.104147000      2.178099000
44      -1.465192000     -0.186554000     -0.174177000
6       -2.906188000      0.421037000     -1.658197000
6       -3.583940000      0.383293000     -0.423153000
6       -2.174391000     -0.718794000     -2.125530000
1       -4.040573000      1.287638000     -0.030820000
6       -3.512587000     -0.783247000      0.386965000
6       -2.310725000     -1.954745000     -1.408176000
1       -1.763718000     -2.826329000     -1.763590000
6       -2.969185000     -1.981984000     -0.183997000
1       -2.978846000     -2.891368000      0.415660000
1       -2.828306000      1.359214000     -2.204410000
6       -1.340110000     -0.640222000     -3.360248000
1       -0.493003000     -1.331569000     -3.306924000
1       -1.940129000     -0.905294000     -4.240362000
1       -0.954142000      0.373658000     -3.508464000
6       -4.103026000     -0.833218000      1.772285000
1       -3.564128000     -1.629097000      2.311239000
6       -3.941592000      0.462533000      2.555749000
1       -4.556032000      1.270461000      2.138554000
1       -4.274904000      0.315515000      3.588012000
1       -2.898118000      0.800507000      2.581275000
6       -5.575485000     -1.236468000      1.662134000
1       -6.017148000     -1.339756000      2.658800000
1       -6.144234000     -0.470057000      1.120177000
1       -5.701907000     -2.188441000      1.134015000
71
E
6       -0.848354000      1.538739000      0.106460000
6       -1.656985000      2.596634000      0.585500000
6       -1.141646000      3.858672000      0.737741000
6        0.200230000      4.160126000      0.411317000
6        0.705260000      5.471072000      0.570180000
6        2.004850000      5.761428000      0.243092000
6        2.838946000      4.741293000     -0.254058000
1        2.391815000      6.769646000      0.364786000
1        0.040552000      6.241890000      0.956788000
6        1.041151000      3.124046000     -0.091073000
6        2.377970000      3.455526000     -0.418980000
6        0.472817000      1.808936000     -0.223397000
1        3.033280000      2.687079000     -0.811138000
1        3.868976000      4.973056000     -0.514571000
1       -1.775904000      4.662114000      1.112241000
1       -2.707651000      2.440297000      0.818187000
44      -1.564517000     -0.400071000     -0.137088000
6        1.244214000      0.678722000     -0.732716000
7        0.567687000     -0.557918000     -0.528555000
8        2.343714000      0.697481000     -1.264557000
16       1.471752000     -1.759545000     -1.142418000
8        1.635962000     -1.899015000     -2.590040000
6        0.712025000     -3.250137000     -0.538758000
6        3.049200000     -1.804743000     -0.315361000
1        1.332759000     -4.059253000     -0.934044000
1        0.721080000     -3.258992000      0.553195000
1       -0.301060000     -3.314489000     -0.942058000
6        4.160329000     -2.115195000     -1.087530000
6        3.119621000     -1.590366000      1.057954000
6        5.390774000     -2.226950000     -0.448410000
1        4.057835000     -2.245538000     -2.161696000
6        5.487001000     -2.025184000      0.924841000
1        6.277422000     -2.464339000     -1.029501000
6        4.357921000     -1.704779000      1.676299000
1        6.452751000     -2.110896000      1.415716000
1        4.444380000     -1.535230000      2.746054000
1        2.232928000     -1.311306000      1.626546000
6       -3.513495000     -0.044629000      0.892562000
6       -1.657991000     -1.225470000      1.996620000
6       -2.951290000     -2.310717000      0.187062000
6       -2.521771000     -0.116616000      1.900629000
6       -3.705938000     -1.116557000     -0.015344000
1       -4.125623000      0.848286000      0.786292000
1       -2.347928000      0.752912000      2.530692000
6       -4.742354000     -1.034600000     -1.086524000
6       -1.941318000     -2.343246000      1.145073000
6       -0.565474000     -1.332508000      3.030435000
1       -3.117893000     -3.166675000     -0.464489000
1       -1.338116000     -3.242011000      1.256345000
1       -4.436425000     -1.578990000     -1.985442000
1       -5.683192000     -1.472949000     -0.732303000
1       -4.940419000      0.004072000     -1.368490000
1        0.194876000     -2.012791000      2.606834000
6        0.110047000     -0.004154000      3.342057000
6       -1.126474000     -1.979939000      4.297579000
1       -0.568889000      0.680826000      3.865954000
1        0.964412000     -0.166172000      4.008482000
1        0.464477000      0.499361000      2.433909000
1       -0.335710000     -2.121296000      5.041988000
1       -1.896108000     -1.337203000      4.744234000
1       -1.580983000     -2.956757000      4.094777000
6       -1.714703000     -0.613096000     -2.366123000
6       -1.950122000      0.590650000     -2.144706000
6       -1.567249000     -1.836602000     -3.164772000
1       -0.518999000     -2.147180000     -3.239151000
1       -2.155950000     -2.669675000     -2.762566000
1       -1.920899000     -1.640165000     -4.183874000
6       -2.327001000      1.974155000     -2.447287000
1       -2.640367000      2.035564000     -3.495393000
1       -3.155646000      2.317211000     -1.816663000
1       -1.491429000      2.666061000     -2.296621000
71
TSEF
6       -1.726286000      0.143415000     -2.144293000
6       -1.307951000      1.248818000     -0.509657000
6       -2.401477000      2.120101000     -0.255295000
6       -0.022590000      1.781781000     -0.545893000
44      -1.421654000     -0.833524000     -0.067094000
6       -2.191574000      3.447067000     -0.001870000
1       -3.419627000      1.735455000     -0.278627000
6       -0.891578000      4.012488000     -0.025292000
1       -3.035961000      4.101514000      0.212066000
6       -0.694844000      5.387544000      0.230367000
6        0.225637000      3.175982000     -0.321455000
6        0.566115000      5.928180000      0.203468000
1       -1.563022000      6.005907000      0.451810000
6        1.672393000      5.104749000     -0.083130000
1        0.714385000      6.986495000      0.401203000
6        1.514875000      3.763274000     -0.340012000
1        2.669280000      5.538139000     -0.106441000
1        2.374184000      3.146780000     -0.578211000
6        1.064847000      0.836494000     -0.819976000
7        0.724026000     -0.484553000     -0.434532000
6       -2.523566000     -0.357860000      1.902772000
6       -3.269193000     -2.055877000      0.247650000
6       -1.245129000     -2.381056000      1.581654000
6       -1.419641000     -1.098095000     -2.130582000
8        2.146470000      1.097148000     -1.321927000
16       1.841305000     -1.519686000     -1.003162000
8        1.971249000     -1.729634000     -2.445096000
6        1.419929000     -3.074456000     -0.254166000
6        3.419571000     -1.171882000     -0.258581000
1        2.156541000     -3.784568000     -0.640753000
1        1.496236000     -2.996150000      0.832564000
1        0.411763000     -3.345991000     -0.576967000
6        4.548840000     -1.415295000     -1.029167000
6        3.486404000     -0.741170000      1.063368000
6        5.795820000     -1.229839000     -0.440590000
1        4.446218000     -1.723883000     -2.066473000
6        4.740334000     -0.560442000      1.631177000
1        2.578007000     -0.521070000      1.623616000
6        5.889312000     -0.808574000      0.881754000
1        6.695654000     -1.409846000     -1.021997000
1        6.867206000     -0.663957000      1.333375000
1        4.822762000     -0.216558000      2.658554000
6       -3.419829000     -0.799177000      0.890312000
1       -4.250517000     -0.162606000      0.592977000
6       -1.391647000     -1.113598000      2.233359000
6       -0.350003000     -0.663755000      3.225251000
6       -2.175567000     -2.874027000      0.654254000
1       -2.019509000     -3.842809000      0.182532000
1       -2.652794000      0.638189000      2.319424000
6       -4.244920000     -2.502109000     -0.791328000
1       -3.793126000     -3.209842000     -1.493899000
1       -5.101581000     -3.000023000     -0.321847000
1       -4.624489000     -1.648256000     -1.362736000
1       -0.374559000     -2.983784000      1.832458000
1        0.602862000     -1.112058000      2.891985000
6       -0.174000000      0.847913000      3.273465000
6       -0.682663000     -1.227760000      4.607320000
1       -1.062523000      1.342154000      3.687508000
1        0.663778000      1.108042000      3.929057000
1        0.021411000      1.272957000      2.280145000
1        0.095851000     -0.963522000      5.330942000
1       -1.632446000     -0.813994000      4.970144000
1       -0.776823000     -2.319872000      4.592678000
6       -1.251497000     -2.280417000     -2.997384000
6       -2.324120000      1.181792000     -3.015436000
1       -0.185092000     -2.488894000     -3.150541000
1       -1.711746000     -3.173316000     -2.557312000
1       -1.702182000     -2.111641000     -3.983599000
1       -2.384740000      0.761858000     -4.027005000
1       -3.337597000      1.455126000     -2.702100000
1       -1.721851000      2.096544000     -3.046264000
71
F
6        5.568552000     -0.813442000     -1.562629000
6        4.918239000     -1.956222000     -1.173448000
6        3.512192000     -1.969085000     -1.013148000
6        2.767447000     -0.775771000     -1.248237000
6        3.465767000      0.385552000     -1.662370000
6        4.830286000      0.361702000     -1.814963000
6        2.830341000     -3.145018000     -0.620876000
6        1.468306000     -3.159424000     -0.478358000
6        0.708330000     -1.981204000     -0.665338000
6        1.357200000     -0.805084000     -1.003220000
6        0.610828000      0.471839000     -0.929730000
7       -0.115513000      0.669284000      0.317760000
8        0.590065000      1.352185000     -1.756028000
16       0.690268000      0.439850000      1.688340000
8        0.941005000     -0.896432000      2.238721000
6       -0.258799000      1.365694000      2.876510000
6        2.226829000      1.307114000      1.503113000
6        3.389131000      0.640660000      1.880155000
6        4.604016000      1.296859000      1.720000000
6        4.635562000      2.591203000      1.208945000
6        3.460286000      3.239007000      0.831744000
6        2.237340000      2.595237000      0.966795000
1        6.648110000     -0.813058000     -1.689258000
1        5.470597000     -2.875656000     -0.986950000
1        2.909724000      1.294008000     -1.875182000
1        5.348087000      1.261065000     -2.140793000
1        3.410422000     -4.050551000     -0.450073000
1        0.955497000     -4.081804000     -0.207510000
1        0.284897000      1.312421000      3.823152000
1       -0.372128000      2.396216000      2.532708000
1       -1.227164000      0.862988000      2.956612000
1        3.331379000     -0.373283000      2.268637000
1        5.527010000      0.793910000      1.994506000
1        5.588932000      3.100436000      1.093564000
1        3.497482000      4.244168000      0.421339000
1        1.315442000      3.071068000      0.636995000
44      -1.929384000     -0.432581000      0.114365000
6       -3.868784000     -0.702850000     -0.944513000
6       -3.403698000      0.485596000     -1.579190000
6       -4.162294000     -0.747662000      0.448997000
1       -3.260312000      0.494140000     -2.655152000
6       -3.058610000      1.590009000     -0.804103000
6       -3.850396000      0.393949000      1.231608000
1       -4.045118000      0.391460000      2.301752000
6       -3.228704000      1.487402000      0.616200000
1       -2.895936000      2.323288000      1.230103000
1       -4.097709000     -1.572822000     -1.556556000
6       -4.816655000     -1.948348000      1.053453000
1       -4.533998000     -2.077687000      2.103349000
1       -5.907256000     -1.840173000      1.016502000
1       -4.559269000     -2.862783000      0.507917000
6       -2.463003000      2.857301000     -1.368973000
1       -1.531588000      3.034994000     -0.803404000
6       -2.106755000      2.762146000     -2.843373000
1       -3.005226000      2.630443000     -3.461333000
1       -1.627484000      3.691034000     -3.168100000
1       -1.406019000      1.945365000     -3.044284000
6       -3.420546000      4.027069000     -1.126215000
1       -2.975174000      4.961097000     -1.484716000
1       -4.358551000      3.873055000     -1.674433000
1       -3.670621000      4.160669000     -0.067562000
6       -0.788895000     -2.100016000     -0.546200000
6       -1.382062000     -2.085809000      0.745598000
6       -1.393624000     -2.986484000     -1.620617000
1       -2.430458000     -3.255296000     -1.382810000
1       -1.385218000     -2.475220000     -2.591590000
1       -0.826602000     -3.919624000     -1.739983000
6       -1.561633000     -3.031926000      1.849232000
1       -2.223317000     -2.661691000      2.639209000
1       -1.927864000     -3.999505000      1.473849000
1       -0.569097000     -3.217682000      2.287015000
71
TSFG
6        1.219587000     -0.741281000     -1.913900000
7       -0.099446000      0.509364000     -0.939657000
6       -1.029200000     -0.049722000      0.021400000
6       -1.400751000     -1.455346000     -0.239185000
6       -2.718500000     -1.887888000      0.131898000
6       -3.060720000     -3.259917000     -0.068350000
6       -4.353969000     -3.732536000      0.261390000
6       -5.301387000     -2.883100000      0.765163000
6       -4.978670000     -1.522871000      0.950666000
1       -6.294427000     -3.246651000      1.015037000
1       -4.575423000     -4.785548000      0.096735000
6       -2.092265000     -4.135439000     -0.594312000
6       -3.731779000     -1.035299000      0.646974000
1       -3.522017000      0.014556000      0.811139000
1       -5.731975000     -0.843321000      1.342128000
6       -0.843639000     -3.694945000     -0.944852000
1       -2.353235000     -5.184687000     -0.723243000
6       -0.468554000     -2.338049000     -0.796275000
1       -0.137467000     -4.414449000     -1.343669000
6        0.918552000     -1.940842000     -1.193282000
8       -1.431514000      0.624337000      0.945865000
16      -0.389870000      1.952286000     -1.614556000
44       1.821310000     -0.301788000     -0.149726000
8       -0.916312000      1.853846000     -2.974362000
6        1.162351000      2.822413000     -1.637204000
6       -1.461104000      3.004422000     -0.656121000
1        0.985131000      3.732334000     -2.217551000
1        1.472373000      3.052823000     -0.616137000
1        1.904701000      2.177511000     -2.114525000
6       -2.674966000      3.342970000     -1.244274000
6       -1.069339000      3.488725000      0.590839000
6       -3.520320000      4.207317000     -0.554291000
1       -2.937732000      2.950761000     -2.222956000
6       -3.140246000      4.713879000      0.683011000
1       -4.472843000      4.489838000     -0.993223000
6       -1.918159000      4.358280000      1.255397000
1       -3.801705000      5.394214000      1.212750000
1       -1.634133000      4.752914000      2.226703000
1       -0.135108000      3.170788000      1.047679000
6        2.591100000     -1.187582000      1.834125000
6        4.050617000     -0.166696000      0.083396000
6        2.557408000      1.195256000      1.442044000
6        3.531236000     -1.305884000      0.766776000
1        3.879152000     -2.294272000      0.473251000
1        2.220083000     -2.086629000      2.317910000
6        2.071081000      0.067127000      2.175638000
6        3.576104000      1.112770000      0.474194000
6        5.077373000     -0.317883000     -0.992347000
6        0.995666000      0.273712000      3.213312000
1        3.950783000      2.007120000     -0.019056000
1        2.122019000      2.169596000      1.670759000
1        4.962339000      0.455029000     -1.759961000
1        6.088420000     -0.230099000     -0.576404000
1        5.004428000     -1.297277000     -1.476237000
1        0.284003000      0.999722000      2.784199000
6        0.213678000     -0.988865000      3.541269000
6        1.612927000      0.874465000      4.477653000
1        0.843475000     -1.730148000      4.050993000
1       -0.612630000     -0.749971000      4.218003000
1       -0.215484000     -1.453134000      2.644756000
1        0.838478000      1.082177000      5.223929000
1        2.328623000      0.171640000      4.923262000
1        2.147415000      1.810375000      4.275730000
6        1.848769000     -3.078448000     -1.590379000
6        1.185998000     -0.430946000     -3.349365000
1        2.842161000     -2.697490000     -1.851078000
1        1.974319000     -3.792056000     -0.766907000
1        1.473871000     -3.633038000     -2.462170000
1        1.581261000      0.552417000     -3.619699000
1        1.827143000     -1.190523000     -3.822450000
1        0.179776000     -0.550223000     -3.769318000
71
G
6        0.996760000      0.085835000     -1.937099000
7       -0.064833000      0.863358000     -1.214711000
6       -1.495178000      0.433830000     -1.279900000
6       -1.674191000     -0.979487000     -1.065562000
6       -2.955620000     -1.490294000     -0.642301000
6       -3.052975000     -2.883378000     -0.355530000
6       -4.276103000     -3.441410000      0.074788000
6       -5.390577000     -2.654661000      0.224038000
6       -5.300743000     -1.279705000     -0.055021000
1       -6.332417000     -3.085825000      0.551823000
1       -4.313830000     -4.509230000      0.283456000
6       -1.907242000     -3.700397000     -0.508402000
6       -4.120494000     -0.705835000     -0.474048000
1       -4.091300000      0.354009000     -0.693566000
1       -6.182109000     -0.652599000      0.056407000
6       -0.710970000     -3.198718000     -0.936302000
1       -1.999609000     -4.762814000     -0.285931000
6       -0.557578000     -1.820020000     -1.233794000
1        0.136406000     -3.868385000     -1.046839000
6        0.737417000     -1.332759000     -1.727610000
8       -2.313110000      1.316248000     -1.419147000
16       0.020184000      2.552095000     -1.184871000
44       1.670915000     -0.391018000     -0.075716000
8       -0.316705000      3.275072000     -2.401496000
6        1.689377000      2.957525000     -0.698070000
6       -0.939187000      3.040890000      0.223999000
1        1.701586000      4.050857000     -0.766556000
1        1.872108000      2.613712000      0.320529000
1        2.403673000      2.512763000     -1.392422000
6       -1.789456000      4.124900000      0.047254000
6       -0.796887000      2.368984000      1.436526000
6       -2.517515000      4.562828000      1.148200000
1       -1.888796000      4.592205000     -0.929352000
6       -2.394673000      3.912882000      2.372771000
1       -3.191819000      5.407706000      1.042772000
6       -1.543065000      2.818254000      2.517222000
1       -2.974152000      4.258157000      3.224714000
1       -1.463927000      2.306913000      3.473322000
1       -0.139489000      1.503574000      1.526062000
6        2.233028000     -1.966087000      1.510558000
6        3.827338000     -0.686803000      0.064881000
6        2.618401000      0.404948000      1.884944000
6        3.124187000     -1.888961000      0.400919000
1        3.293289000     -2.775472000     -0.208768000
1        1.715555000     -2.898955000      1.721454000
6        1.915427000     -0.797879000      2.217651000
6        3.590670000      0.461338000      0.873058000
6        4.812189000     -0.649263000     -1.059167000
6        0.872595000     -0.784545000      3.311445000
1        4.123383000      1.388411000      0.666423000
1        2.371018000      1.310777000      2.440550000
1        4.786268000      0.320944000     -1.569980000
1        5.833586000     -0.807562000     -0.691387000
1        4.604648000     -1.431347000     -1.797247000
1        0.665671000      0.275224000      3.539985000
6       -0.439317000     -1.442670000      2.895150000
6        1.436229000     -1.430979000      4.576745000
1       -0.309091000     -2.515736000      2.706199000
1       -1.184252000     -1.345889000      3.693158000
1       -0.852305000     -0.995884000      1.979917000
1        0.717365000     -1.364576000      5.400760000
1        1.649217000     -2.493677000      4.404278000
1        2.367472000     -0.950236000      4.896334000
6        1.546432000     -2.292148000     -2.571798000
6        1.489246000      0.657158000     -3.238111000
1        2.529539000     -1.877683000     -2.815021000
1        1.732280000     -3.240587000     -2.058703000
1        1.035228000     -2.529448000     -3.515467000
1        1.898370000      1.669948000     -3.162520000
1        2.287344000      0.026185000     -3.637071000
1        0.683092000      0.691494000     -3.984362000
17
PhSOMe
16       1.676706000     -0.140259000     -0.469651000
8        2.192498000      1.262139000     -0.339633000
6        2.034718000     -0.960235000      1.119735000
6       -0.116437000     -0.067043000     -0.204820000
6       -0.664774000      1.150148000      0.171395000
6       -2.040409000      1.238012000      0.360753000
6       -2.844637000      0.119363000      0.166094000
6       -2.280937000     -1.093222000     -0.224364000
6       -0.907947000     -1.189900000     -0.419076000
1        1.681013000     -0.304755000      1.921603000
1        1.535308000     -1.932809000      1.162158000
1        3.118254000     -1.086191000      1.187844000
1        0.000046000      2.003256000      0.297488000
1       -2.487432000      2.183934000      0.657342000
1       -3.919726000      0.193025000      0.310837000
1       -2.914306000     -1.962303000     -0.384760000
1       -0.457912000     -2.129858000     -0.739333000
29
H
6       -2.804391000     -0.506427000      0.000007000
7       -2.121733000     -1.647266000     -0.000112000
6       -0.747936000     -1.655165000     -0.000155000
6       -0.042571000     -0.353476000     -0.000047000
6        1.394157000     -0.251712000     -0.000015000
6        2.015889000      1.036232000     -0.000123000
6        3.420272000      1.155629000     -0.000039000
6        4.230388000      0.044170000      0.000162000
6        3.632317000     -1.228150000      0.000283000
1        5.314741000      0.147691000      0.000253000
1        3.849114000      2.159566000     -0.000164000
6        1.197922000      2.199672000     -0.000272000
6        2.263104000     -1.377656000      0.000175000
1        1.786956000     -2.353606000      0.000210000
1        4.263141000     -2.117098000      0.000464000
6       -0.155266000      2.101638000     -0.000181000
1        1.686123000      3.176111000     -0.000538000
6       -0.821518000      0.831121000      0.000002000
1       -0.759194000      3.007496000     -0.000300000
6       -2.237154000      0.769129000      0.000148000
8       -0.149344000     -2.747730000     -0.000278000
6       -3.062525000      2.023101000      0.000280000
6       -4.305164000     -0.687065000      0.000055000
1       -4.133925000      1.798991000      0.001460000
1       -2.873291000      2.659018000      0.880565000
1       -2.875031000      2.658171000     -0.881012000
1       -4.517854000     -1.759246000     -0.000611000
1       -4.779316000     -0.235954000      0.883127000
1       -4.779724000     -0.234684000     -0.882134000
30
I
6       -0.029467000     -0.329733000      0.000301000
6       -0.809325000      0.856866000      0.000324000
6       -0.143117000      2.124012000      0.000415000
6        1.208344000      2.204493000      0.000162000
6        2.025457000      1.036784000     -0.000069000
6        1.420438000     -0.251909000      0.000143000
6       -0.789287000     -1.530439000      0.000251000
7       -2.099446000     -1.586833000     -0.000220000
6       -2.826243000     -0.449467000     -0.000345000
6       -2.228989000      0.798419000      0.000095000
8       -0.168154000     -2.728545000      0.000822000
6        2.287834000     -1.367995000      0.000005000
6        3.658023000     -1.211495000     -0.000242000
6        4.242325000      0.061901000     -0.000472000
6        3.427391000      1.168578000     -0.000419000
1       -0.738397000      3.032262000      0.000693000
1        1.702902000      3.175063000      0.000078000
1        4.291067000     -2.095910000     -0.000189000
1        5.323906000      0.171380000     -0.000793000
1        3.850304000      2.172295000     -0.000665000
6       -4.313577000     -0.646677000     -0.000910000
1       -4.786765000     -0.198634000      0.881403000
1       -4.786201000     -0.198035000     -0.883211000
1       -4.532473000     -1.716662000     -0.001318000
6       -3.042944000      2.058483000      0.000281000
1       -2.835932000      2.678338000     -0.881771000
1       -4.114428000      1.846786000      0.000370000
1       -2.835757000      2.678123000      0.882447000
1        1.873700000     -2.366058000      0.000076000
1       -0.891754000     -3.373692000      0.000718000
30
J
6       -0.006085000     -0.333792000      0.001715000
6       -0.785092000      0.839891000      0.002622000
6       -0.124866000      2.104073000      0.002873000
6        1.231862000      2.191310000      0.001977000
6        2.046985000      1.031464000      0.000613000
6        1.432972000     -0.255249000      0.000676000
6       -0.686028000     -1.629809000      0.001140000
7       -2.074722000     -1.544715000      0.002095000
6       -2.845421000     -0.411286000      0.003228000
6       -2.228824000      0.802272000      0.002476000
8       -0.185064000     -2.749549000      0.000524000
6        2.289699000     -1.385099000     -0.000664000
6        3.657399000     -1.234919000     -0.002277000
6        4.253468000      0.038028000     -0.002544000
6        3.452915000      1.152215000     -0.001051000
1       -0.719733000      3.012576000      0.003640000
1        1.719425000      3.165557000      0.002122000
1        4.287229000     -2.121801000     -0.003375000
1        5.336269000      0.136428000     -0.003930000
1        3.884834000      2.152167000     -0.001157000
6       -4.326255000     -0.631750000     -0.003689000
1       -4.813450000     -0.127111000      0.837309000
1       -4.784695000     -0.252421000     -0.924128000
1       -4.569330000     -1.696417000      0.068883000
6       -3.022201000      2.073894000     -0.003940000
1       -2.803251000      2.686840000     -0.888042000
1       -4.097785000      1.880582000     -0.007457000
1       -2.808251000      2.694343000      0.876170000
1        1.844321000     -2.371851000     -0.000531000
1       -2.515179000     -2.456935000      0.002704000
61
K
6       -0.703595000      1.776807000      0.229701000
6        1.575712000      2.635098000      0.494290000
6       -1.719025000      0.814419000      0.508662000
6       -0.982680000      2.863681000     -0.641711000
6       -3.056352000      1.060885000      0.114237000
6       -1.419050000     -0.469428000      1.095653000
6       -3.315917000      2.200811000     -0.722678000
6       -4.078433000      0.174052000      0.518469000
7       -2.408488000     -1.255487000      1.522168000
8       -0.214856000     -0.949383000      1.158174000
6       -2.319120000      3.032758000     -1.121436000
1       -4.332596000      2.379719000     -1.064457000
6       -3.688271000     -0.925424000      1.287191000
6       -5.508563000      0.429391000      0.141955000
1       -2.530141000      3.869702000     -1.786434000
6        0.050124000      3.760277000     -0.973649000
6        1.325734000      3.641603000     -0.442316000
1       -0.180594000      4.579552000     -1.655163000
6       -4.695857000     -1.875843000      1.870138000
1       -5.443520000     -1.356393000      2.481574000
1       -5.241005000     -2.421697000      1.088718000
1       -4.173516000     -2.603707000      2.494553000
1       -5.655877000      0.422268000     -0.947201000
1       -6.178014000     -0.328830000      0.555430000
1       -5.865503000      1.402943000      0.504967000
1        2.530997000      2.573689000      1.015500000
1        2.098748000      4.359152000     -0.707971000
6        0.588724000      1.704144000      0.830310000
1        0.736765000      1.154193000      1.771406000
8        1.814889000      0.600389000      3.227131000
6        2.516009000     -0.297480000      2.777098000
6        3.431149000     -1.093727000      3.685765000
1        2.998070000     -2.088770000      3.835032000
1        3.524606000     -0.596877000      4.653775000
1        4.415566000     -1.230712000      3.228816000
44       1.355754000     -0.328501000     -0.085141000
8        2.593448000     -0.693552000      1.539863000
1        4.636356000      0.775642000     -0.683368000
1        4.709047000      0.824076000     -2.455952000
6        4.051043000      0.967583000     -1.590066000
1        3.735364000      2.015792000     -1.578555000
6        2.871915000      0.051641000     -1.655211000
1        1.442689000      1.559079000     -2.294780000
6        1.581452000      0.501551000     -2.069624000
6        0.456264000     -0.362284000     -2.125386000
1       -0.511289000      0.048993000     -2.399806000
6        0.556261000     -1.693882000     -1.645163000
1        1.905858000     -3.120107000     -0.693832000
6        1.826319000     -2.143369000     -1.165050000
6        2.957562000     -1.283863000     -1.192243000
1        3.871476000     -1.605912000     -0.696624000
6       -0.634072000     -2.610739000     -1.499799000
1       -0.685295000     -2.859095000     -0.426337000
1        0.504816000     -4.423243000     -2.006994000
1       -1.249442000     -4.576576000     -2.166054000
6       -0.405726000     -3.891792000     -2.304516000
1       -0.329530000     -3.667471000     -3.376667000
1       -1.980687000     -1.758328000     -2.979349000
6       -1.955065000     -1.973162000     -1.901768000
1       -2.778187000     -2.661709000     -1.682107000
1       -2.156024000     -1.044810000     -1.355548000
61
TSKL
6       -0.774612000      1.726193000     -0.266606000
6        1.464134000      2.698015000     -0.239085000
6       -1.754115000      0.767493000      0.167485000
6       -1.175533000      2.788970000     -1.125501000
6       -3.118462000      0.942863000     -0.183785000
6       -1.427801000     -0.390311000      0.967485000
6       -3.471534000      2.018865000     -1.065309000
6       -4.108330000      0.074997000      0.332489000
7       -2.388945000     -1.155891000      1.485844000
8       -0.213380000     -0.788546000      1.204091000
6       -2.541487000      2.888720000     -1.529214000
1       -4.511784000      2.133793000     -1.359280000
6       -3.679595000     -0.921234000      1.205090000
6       -5.553468000      0.257947000     -0.028755000
1       -2.825521000      3.701909000     -2.196807000
6       -0.235142000      3.747069000     -1.546190000
6        1.074987000      3.721756000     -1.104026000
1       -0.575448000      4.539964000     -2.212475000
6       -4.647361000     -1.849444000      1.884529000
1       -5.394633000     -1.302783000      2.472856000
1       -5.195845000     -2.469119000      1.163087000
1       -4.090477000     -2.509997000      2.552597000
1       -5.715943000      0.206944000     -1.114104000
1       -6.182912000     -0.513119000      0.422399000
1       -5.945787000      1.228373000      0.306248000
1        2.481293000      2.679317000      0.158698000
1        1.776888000      4.494682000     -1.408987000
6        0.587051000      1.685115000      0.162227000
1        0.774260000      1.437462000      1.409119000
8        1.068499000      1.436476000      2.712598000
6        1.991731000      0.595752000      2.843095000
6        2.625947000      0.443092000      4.197119000
1        1.990763000     -0.215224000      4.799462000
1        2.675588000      1.410983000      4.701323000
1        3.617172000     -0.007677000      4.117756000
44       1.434467000     -0.351384000      0.054481000
8        2.430948000     -0.150881000      1.914766000
1        4.738370000      0.757520000     -0.335694000
1        5.110622000      0.346248000     -2.020891000
6        4.315019000      0.683279000     -1.344878000
1        4.009317000      1.685953000     -1.661429000
6        3.156501000     -0.261381000     -1.358588000
1        1.817815000      1.014007000     -2.495252000
6        1.935389000      0.039766000     -2.020874000
6        0.822201000     -0.846378000     -2.001862000
1       -0.107639000     -0.534223000     -2.467851000
6        0.884904000     -2.061051000     -1.264025000
1        2.134639000     -3.241779000      0.071989000
6        2.096708000     -2.374634000     -0.582307000
6        3.186748000     -1.469587000     -0.608999000
1        4.040445000     -1.655709000      0.041375000
6       -0.306619000     -2.971894000     -1.077467000
1       -0.468720000     -3.027484000      0.011804000
1        0.902573000     -4.808017000     -1.133870000
1       -0.824273000     -5.044581000     -1.436388000
6        0.019924000     -4.368405000     -1.610926000
1        0.204271000     -4.335584000     -2.692944000
1       -1.507776000     -2.444142000     -2.813639000
6       -1.588749000     -2.460374000     -1.717649000
1       -2.418787000     -3.126288000     -1.457720000
1       -1.861529000     -1.456909000     -1.371921000
61
L
6       -0.820222000      1.581187000     -0.662429000
6        1.422338000      2.233933000     -1.290440000
6       -1.788564000      0.751692000      0.020000000
6       -1.309323000      2.701150000     -1.397104000
6       -3.176926000      0.928617000     -0.189564000
6       -1.415219000     -0.243155000      0.974761000
6       -3.613293000      2.030084000     -0.993437000
6       -4.105758000      0.037589000      0.408969000
7       -2.285625000     -1.085084000      1.505677000
8       -0.167888000     -0.333808000      1.420182000
6       -2.717679000      2.894010000     -1.532920000
1       -4.678074000      2.186601000     -1.146179000
6       -3.598871000     -0.970684000      1.214705000
6       -5.576567000      0.202658000      0.163884000
1       -3.059158000      3.750427000     -2.114385000
6       -0.416333000      3.596146000     -2.015553000
6        0.939359000      3.381272000     -1.940110000
1       -0.822459000      4.450524000     -2.555770000
6       -4.477890000     -2.009630000      1.853075000
1       -5.207661000     -1.566122000      2.542366000
1       -5.045517000     -2.583613000      1.109342000
1       -3.850793000     -2.700691000      2.421051000
1       -5.817602000      0.184026000     -0.907464000
1       -6.159491000     -0.589652000      0.639707000
1       -5.950962000      1.158315000      0.556223000
1        2.499915000      2.062648000     -1.275664000
1        1.636962000      4.075762000     -2.405162000
6        0.578784000      1.314449000     -0.677670000
1        0.256880000      0.896551000      2.195414000
8        0.696135000      1.709733000      2.642835000
6        1.925015000      1.805119000      2.247115000
6        2.676716000      2.966163000      2.810380000
1        2.370347000      3.165543000      3.839621000
1        2.429532000      3.848399000      2.208450000
1        3.751764000      2.792190000      2.746524000
44       1.445853000     -0.385238000      0.088131000
8        2.467343000      1.032761000      1.442743000
1        4.817805000      0.056810000      0.542905000
1        5.561196000     -0.928796000     -0.734785000
6        4.698691000     -0.297521000     -0.486806000
1        4.714952000      0.575790000     -1.147239000
6        3.420043000     -1.056951000     -0.631448000
1        2.828808000     -0.112675000     -2.491216000
6        2.561082000     -0.846978000     -1.734127000
6        1.280268000     -1.474371000     -1.776671000
1        0.585332000     -1.214774000     -2.570791000
6        0.865007000     -2.334622000     -0.726874000
1        1.478584000     -3.272673000      1.144896000
6        1.807743000     -2.648305000      0.316684000
6        3.048422000     -2.026834000      0.365906000
1        3.697934000     -2.169771000      1.227105000
6       -0.489614000     -3.000488000     -0.686339000
1       -0.882031000     -2.853532000      0.333981000
1        0.359903000     -4.970050000     -0.217927000
1       -1.284297000     -5.010742000     -0.876200000
6       -0.316885000     -4.499685000     -0.940269000
1        0.091030000     -4.674789000     -1.945131000
1       -1.222789000     -2.643939000     -2.705608000
6       -1.499010000     -2.420378000     -1.665609000
1       -2.483660000     -2.867499000     -1.487175000
1       -1.607190000     -1.334494000     -1.559126000
53
M
6        0.113288000      1.656309000      0.231245000
6        1.529491000      1.401926000      0.232357000
44      -1.326701000      0.263839000     -0.168438000
6       -0.304081000      2.969487000      0.504655000
6        2.136806000      0.113498000      0.012183000
6        2.417921000      2.503202000      0.481279000
6        3.552948000     -0.053802000      0.043106000
6        1.383028000     -1.076089000     -0.237723000
6        4.381763000      1.088883000      0.280975000
6        4.132985000     -1.324755000     -0.151034000
7        1.945886000     -2.273980000     -0.403085000
8        0.082892000     -1.086322000     -0.327037000
6        3.832040000      2.305709000      0.489882000
1        5.461439000      0.970092000      0.298820000
6        3.273536000     -2.404043000     -0.361748000
6        5.623478000     -1.496233000     -0.120302000
1        4.463505000      3.173883000      0.677233000
6        1.925156000      3.788550000      0.726321000
6        0.565429000      4.026928000      0.744627000
1        2.637673000      4.592205000      0.909252000
6        3.784165000     -3.803462000     -0.559986000
1        4.419194000     -3.885522000     -1.451271000
1        4.380558000     -4.147665000      0.294281000
1        2.931336000     -4.474791000     -0.681601000
1        6.050645000     -1.203997000      0.848642000
1        5.915837000     -2.533321000     -0.299701000
1        6.122086000     -0.884669000     -0.884241000
6       -2.984172000     -1.068419000     -1.041433000
6       -3.061098000      0.084045000      1.092692000
6       -3.061987000      1.426727000     -0.959708000
1       -1.369143000      3.186609000      0.535443000
1        0.177965000      5.023986000      0.944572000
6       -3.025864000     -1.149486000      0.354814000
6       -2.911877000     -2.446953000      1.113608000
6       -2.879948000      0.201676000     -1.675892000
1       -2.695337000      0.247637000     -2.747800000
6       -3.180141000      1.341233000      0.442779000
1       -3.233084000      2.249813000      1.038245000
1       -2.807532000     -1.964945000     -1.628833000
1       -3.032088000      0.042285000      2.180343000
1       -2.331988000     -2.214917000      2.021836000
6       -4.306944000     -2.909442000      1.536491000
6       -2.171453000     -3.538094000      0.353575000
6       -3.068131000      2.729183000     -1.691621000
1       -2.864960000      3.571959000     -1.024144000
1       -2.306696000      2.733113000     -2.479537000
1       -4.043981000      2.901235000     -2.162687000
1       -4.245678000     -3.817130000      2.147779000
1       -4.835393000     -2.142707000      2.116020000
1       -4.914915000     -3.140255000      0.651559000
1       -1.186249000     -3.194603000      0.014927000
1       -2.032344000     -4.411017000      1.000998000
1       -2.748373000     -3.877237000     -0.517825000
63
N
6        2.213927000      0.842497000      2.057256000
6        0.422850000      1.716569000     -0.031615000
6       -0.996655000      1.834167000     -0.102831000
44       1.395041000     -0.114842000      0.175056000
6        1.194083000      2.830619000     -0.337839000
6        2.082187000     -0.371080000      2.295070000
6        2.535136000      2.233514000      2.391096000
6       -1.919151000      0.754661000      0.171071000
6       -1.548945000      3.083295000     -0.524651000
6       -3.307295000      0.898478000     -0.066378000
6       -1.500952000     -0.479188000      0.765677000
6       -3.799057000      2.162284000     -0.523589000
6       -4.195763000     -0.182791000      0.173220000
7       -2.342906000     -1.490827000      0.966186000
8       -0.284654000     -0.669536000      1.199190000
6       -2.958286000      3.207522000     -0.712359000
1       -4.864854000      2.285821000     -0.697955000
6       -3.650115000     -1.355007000      0.672860000
6       -5.664240000     -0.036053000     -0.098360000
1       -3.343133000      4.173281000     -1.040180000
6       -0.722578000      4.188114000     -0.800128000
6        0.641611000      4.067935000     -0.702035000
1       -1.187044000      5.123787000     -1.109171000
6       -4.481236000     -2.580172000      0.938853000
1       -5.246132000     -2.400624000      1.705276000
1       -5.003968000     -2.929586000      0.039283000
1       -3.824810000     -3.379601000      1.292161000
1       -5.863603000      0.278365000     -1.131953000
1       -6.199814000     -0.975644000      0.059546000
1       -6.132041000      0.713225000      0.555889000
6        2.269900000     -2.188670000     -0.486143000
6        0.981097000     -0.707253000     -1.917253000
6        3.239842000     -0.001771000     -1.189018000
1        2.280719000      2.750855000     -0.302698000
1        1.293847000      4.910436000     -0.925234000
6        1.958010000     -1.670779000      2.949585000
1        3.289720000      2.658313000      1.718658000
1        1.647318000      2.869964000      2.323326000
1        2.926118000      2.283755000      3.413722000
1        0.945935000     -2.060378000      2.787723000
1        2.683909000     -2.398805000      2.566241000
1        2.121477000     -1.566452000      4.029138000
6        1.094976000     -1.948172000     -1.223674000
6       -0.055353000     -2.919596000     -1.276333000
6        3.271846000     -1.186237000     -0.401137000
1        4.113559000     -1.335431000      0.276021000
6        2.061707000      0.219937000     -1.931676000
1        1.936653000      1.169306000     -2.449959000
1        2.358815000     -3.089939000      0.113159000
1        0.059771000     -0.475307000     -2.448979000
1       -0.972332000     -2.311996000     -1.332816000
6        0.068378000     -3.748071000     -2.557137000
6       -0.179444000     -3.808700000     -0.049362000
6        4.379514000      0.964980000     -1.170873000
1        4.064675000      1.960524000     -1.501035000
1        4.797199000      1.052332000     -0.160653000
1        5.186912000      0.635314000     -1.836721000
1       -0.784652000     -4.429012000     -2.653555000
1        0.105775000     -3.118387000     -3.454052000
1        0.983040000     -4.356081000     -2.533567000
1       -0.292482000     -3.200668000      0.854195000
1       -1.078540000     -4.428992000     -0.139102000
1        0.677790000     -4.489418000      0.050230000
63
TSNO
6       -0.849535000     -1.382720000      2.011665000
6       -0.156080000     -1.745064000      0.135792000
6        1.245649000     -1.599492000     -0.118989000
44      -1.418310000     -0.040720000      0.126015000
6       -0.776869000     -2.970126000     -0.102202000
6       -1.825362000     -0.570861000      2.096418000
6        0.151019000     -2.165688000      2.762587000
6        1.990022000     -0.372123000      0.059288000
6        1.936483000     -2.747732000     -0.610079000
6        3.374052000     -0.326027000     -0.255575000
6        1.409683000      0.846680000      0.574798000
6        4.017796000     -1.511248000     -0.735263000
6        4.117000000      0.871173000     -0.097397000
7        2.122880000      1.970360000      0.671114000
8        0.188732000      0.929733000      1.006682000
6        3.329918000     -2.665891000     -0.899985000
1        5.077900000     -1.475406000     -0.972037000
6        3.429095000      1.986932000      0.357472000
6        5.581840000      0.912915000     -0.422512000
1        3.828759000     -3.561240000     -1.270395000
6        1.263518000     -3.965867000     -0.835662000
6       -0.085700000     -4.081681000     -0.595132000
1        1.840928000     -4.812166000     -1.206029000
6        4.098166000      3.322221000      0.532897000
1        4.913539000      3.278087000      1.266173000
1        4.529172000      3.694228000     -0.405388000
1        3.356909000      4.042506000      0.886585000
1        5.781486000      0.684514000     -1.479027000
1        6.009384000      1.899050000     -0.224681000
1        6.158015000      0.190588000      0.172116000
6       -3.001613000      1.532721000     -0.259358000
6       -1.262325000      0.976951000     -1.892395000
6       -2.994354000     -0.701919000     -1.352259000
1       -1.831215000     -3.070916000      0.152526000
1       -0.605920000     -5.021874000     -0.766215000
6       -2.776215000      0.045229000      3.040311000
1        0.227023000     -3.204097000      2.420758000
1        1.143276000     -1.705662000      2.676662000
1       -0.140669000     -2.153882000      3.820985000
1       -2.579958000      1.123911000      3.101385000
1       -3.815867000     -0.075946000      2.710914000
1       -2.687008000     -0.379470000      4.048467000
6       -1.816009000      1.890164000     -0.932880000
6       -1.102446000      3.195727000     -0.688520000
6       -3.537331000      0.222345000     -0.424652000
1       -4.394079000     -0.084375000      0.175072000
6       -1.834995000     -0.289822000     -2.078951000
1       -1.337836000     -1.015353000     -2.722436000
1       -3.418455000      2.191331000      0.497324000
1       -0.330683000      1.238345000     -2.390641000
1       -0.028653000      2.989208000     -0.815855000
6       -1.548648000      4.206135000     -1.745970000
6       -1.278651000      3.746431000      0.718040000
6       -3.644049000     -2.026068000     -1.599209000
1       -2.920641000     -2.764242000     -1.960898000
1       -4.104791000     -2.417243000     -0.684489000
1       -4.433672000     -1.933208000     -2.355989000
1       -0.997938000      5.147063000     -1.634029000
1       -1.384440000      3.834462000     -2.764847000
1       -2.619303000      4.428020000     -1.638199000
1       -0.948385000      3.008939000      1.457563000
1       -0.657959000      4.641402000      0.837588000
1       -2.317660000      4.044960000      0.917449000
63
O
6       -2.103984000     -0.310601000      0.058220000
6       -3.425470000     -0.292649000      0.575495000
6       -3.872041000     -1.443753000      1.309511000
6       -3.043663000     -2.494883000      1.541049000
6       -1.751194000     -2.568623000      0.933229000
6       -1.338209000     -1.504881000      0.084510000
6       -1.534925000      0.961888000     -0.310310000
7       -2.339325000      1.998021000     -0.583392000
6       -3.641213000      1.929827000     -0.283538000
6       -4.228877000      0.849911000      0.387675000
8       -0.271089000      1.196396000     -0.256114000
6       -0.191652000     -1.705757000     -0.764244000
6        0.613892000     -2.834127000     -0.530508000
6        0.294285000     -3.789495000      0.439979000
6       -0.908838000     -3.678050000      1.113636000
6       -0.042661000     -1.055785000     -2.120621000
6        0.964622000     -0.186154000     -2.112911000
1       -4.873410000     -1.442225000      1.733632000
1       -3.367132000     -3.328610000      2.163624000
1        1.456504000     -2.993635000     -1.202309000
1        0.933996000     -4.656437000      0.589992000
1       -1.231610000     -4.466606000      1.793536000
6        1.501785000      0.684031000     -3.186094000
1        1.329310000      1.739596000     -2.932222000
1        2.585716000      0.557315000     -3.315819000
1        1.026641000      0.493782000     -4.159115000
6       -0.956565000     -1.494524000     -3.223524000
1       -0.861548000     -2.570809000     -3.425036000
1       -2.004816000     -1.309696000     -2.950333000
1       -0.750859000     -0.953869000     -4.153601000
6       -4.442742000      3.139581000     -0.674343000
1       -5.338387000      2.872373000     -1.248308000
1       -4.779361000      3.703924000      0.205276000
1       -3.815765000      3.797783000     -1.280025000
6       -5.647559000      0.878238000      0.875723000
1       -5.709006000      0.782129000      1.969104000
1       -6.148601000      1.813357000      0.612299000
1       -6.249022000      0.062145000      0.451680000
44       1.402866000     -0.088295000     -0.123277000
6        3.145024000      1.201370000     -0.170729000
6        2.345075000      1.593142000      0.937577000
6        3.574298000     -0.152409000     -0.293521000
1        4.129939000     -0.471797000     -1.173828000
6        2.085011000      0.644587000      1.982361000
6        3.223848000     -1.111984000      0.687845000
1        1.455420000      0.942864000      2.817609000
6        2.490470000     -0.680976000      1.843151000
1        2.180448000     -1.427405000      2.572852000
1        3.360419000      1.912067000     -0.964534000
6        3.687147000     -2.528855000      0.574123000
1        2.956138000     -3.221244000      1.006386000
1        3.852692000     -2.810702000     -0.471838000
1        4.634502000     -2.666349000      1.111214000
6        1.813079000      2.996217000      1.092138000
1        0.844930000      2.900429000      1.606262000
6        2.774800000      3.782235000      1.985670000
1        2.387536000      4.790501000      2.172466000
1        2.932846000      3.292982000      2.954611000
1        3.753934000      3.883557000      1.497630000
6        1.559647000      3.726309000     -0.218525000
1        0.842931000      3.171078000     -0.833046000
1        1.133956000      4.714213000     -0.008936000
1        2.489245000      3.893984000     -0.780531000
63
TSOP
6       -0.749471000     -0.049876000      1.980615000
8        0.387550000      1.024311000      0.851237000
6        1.662848000      0.746433000      0.645856000
6        2.113965000     -0.465949000      0.033477000
6        3.459507000     -0.439822000     -0.421881000
6        1.273686000     -1.621866000     -0.234198000
6        3.916183000     -1.472546000     -1.299509000
6        4.330841000      0.620021000     -0.059131000
6        3.073318000     -2.445763000     -1.713005000
1        4.936438000     -1.440127000     -1.671815000
6        1.750941000     -2.567700000     -1.188930000
1        3.405160000     -3.199096000     -2.426727000
6        0.989097000     -3.684916000     -1.584662000
6        0.034933000     -1.938646000      0.434211000
7        2.485794000      1.727163000      0.984191000
6        3.796458000      1.653846000      0.691667000
6        4.624156000      2.804491000      1.190425000
6        5.765238000      0.612982000     -0.499486000
44      -1.513194000      0.091493000      0.228022000
6       -0.665372000     -3.083690000      0.020159000
6       -0.457585000     -1.371799000      1.734879000
6       -0.226508000     -3.929953000     -0.995324000
1       -1.600088000     -3.317383000      0.527510000
1       -0.824848000     -4.792656000     -1.280638000
1        1.403113000     -4.359833000     -2.331756000
6       -0.822577000     -2.371310000      2.808933000
6       -0.944916000      0.722828000      3.221841000
1       -0.904664000      1.790634000      2.982619000
1       -1.936460000      0.504778000      3.642188000
1       -0.184860000      0.504319000      3.982490000
1       -1.862338000     -2.723295000      2.735292000
1       -0.175649000     -3.255099000      2.747361000
1       -0.706735000     -1.924855000      3.803887000
1        5.472769000      2.469614000      1.799786000
1        5.035529000      3.400307000      0.365282000
1        3.992402000      3.455698000      1.798849000
1        5.861883000      0.699354000     -1.591035000
1        6.323877000      1.444810000     -0.063276000
1        6.281585000     -0.310986000     -0.207192000
6       -2.093585000      1.757830000     -1.100348000
6       -3.608573000      0.582334000      0.429174000
6       -2.883679000     -0.500219000     -1.666653000
6       -2.913628000      1.766011000      0.063963000
1       -2.930318000      2.634547000      0.718772000
6       -2.174175000      0.640286000     -2.003697000
6       -1.240545000      2.940607000     -1.496723000
1       -4.160902000      0.539390000      1.367244000
6       -3.510887000     -0.592596000     -0.378532000
1       -1.572410000      0.663208000     -2.910459000
6       -4.189147000     -1.858082000      0.045914000
1       -2.836049000     -1.386151000     -2.296375000
1       -3.697101000     -2.731957000     -0.395246000
1       -4.163483000     -1.967962000      1.136855000
1       -5.240911000     -1.871873000     -0.269050000
1       -0.329036000      2.522089000     -1.954584000
6       -1.983918000      3.762238000     -2.551654000
6       -0.808709000      3.821737000     -0.332882000
1       -1.367716000      4.601243000     -2.895552000
1       -2.260145000      3.162021000     -3.426895000
1       -2.908200000      4.176603000     -2.125802000
1       -0.270800000      3.244621000      0.428035000
1       -0.139459000      4.609014000     -0.698015000
1       -1.668402000      4.327253000      0.129040000
63
P
6       -0.137013000      0.603186000      1.040360000
8        0.631001000      1.159276000     -0.013375000
6        1.989773000      1.119777000      0.109373000
6        2.679064000     -0.096692000     -0.106714000
6        4.079221000      0.029376000     -0.294271000
6        2.017922000     -1.371453000     -0.270743000
6        4.810171000     -1.098134000     -0.789010000
6        4.714666000      1.274253000     -0.061592000
6        4.165230000     -2.241340000     -1.122432000
1        5.881004000     -1.009271000     -0.950526000
6        2.768012000     -2.420698000     -0.874921000
1        4.712057000     -3.076509000     -1.558722000
6        2.171131000     -3.657700000     -1.170024000
6        0.696360000     -1.665112000      0.191652000
7        2.569243000      2.278896000      0.298517000
6        3.915537000      2.361944000      0.263478000
6        4.478856000      3.723626000      0.549957000
6        6.202154000      1.402935000     -0.207333000
44      -1.692379000     -0.200051000     -0.011212000
6        0.152640000     -2.914351000     -0.128288000
6       -0.085646000     -0.836350000      1.161292000
6        0.857600000     -3.892078000     -0.829130000
1       -0.860828000     -3.125022000      0.210802000
1        0.384763000     -4.843656000     -1.060423000
1        2.772629000     -4.426225000     -1.653092000
6       -0.273768000     -1.492591000      2.510494000
6       -0.265312000      1.560775000      2.186317000
1       -0.597122000      2.536134000      1.812582000
1       -0.990128000      1.212554000      2.930008000
1        0.700265000      1.713206000      2.692151000
1       -0.687746000     -2.504815000      2.419376000
1        0.686647000     -1.587523000      3.040259000
1       -0.948801000     -0.917202000      3.153664000
1        5.169593000      3.712340000      1.402402000
1        5.031578000      4.127122000     -0.307734000
1        3.656815000      4.405270000      0.778847000
1        6.516787000      1.318283000     -1.256619000
1        6.564051000      2.365717000      0.160860000
1        6.734016000      0.622041000      0.350120000
6       -3.471378000      1.105006000     -0.768648000
6       -3.372907000     -0.337742000      1.247798000
6       -3.544897000     -1.389644000     -0.930926000
6       -3.386542000      0.965042000      0.641445000
1       -3.345302000      1.847401000      1.279619000
6       -3.435215000     -0.095187000     -1.516744000
6       -3.526189000      2.446525000     -1.455681000
1       -3.323628000     -0.421074000      2.334381000
6       -3.509816000     -1.534445000      0.462571000
1       -3.358694000     -0.022016000     -2.600892000
6       -3.601597000     -2.871573000      1.126703000
1       -3.550826000     -2.271364000     -1.567786000
1       -3.293689000     -3.675034000      0.447562000
1       -2.967844000     -2.915687000      2.021130000
1       -4.630216000     -3.083965000      1.446359000
1       -3.235300000      2.274831000     -2.504410000
6       -4.961136000      2.974373000     -1.441199000
6       -2.565329000      3.473082000     -0.868635000
1       -5.038437000      3.924769000     -1.983189000
1       -5.657118000      2.260481000     -1.896980000
1       -5.291452000      3.149836000     -0.408194000
1       -1.536402000      3.095711000     -0.851720000
1       -2.588238000      4.397273000     -1.458395000
1       -2.846028000      3.743322000      0.158360000
38
Q
6       -0.409732000      0.301878000     -0.136435000
6       -1.513481000      1.150845000      0.122395000
6       -1.279423000      2.558950000      0.231883000
6       -0.036270000      3.063475000      0.043744000
6        1.105132000      2.220784000     -0.136143000
6        0.943892000      0.807794000     -0.138325000
6       -0.745529000     -1.020001000     -0.500154000
7       -1.941255000     -1.538307000     -0.428296000
6       -2.971945000     -0.756707000     -0.036074000
6       -2.818538000      0.602107000      0.202813000
8        0.214606000     -1.803260000     -1.084601000
6        2.114810000     -0.007962000     -0.058991000
6        3.356743000      0.616278000     -0.145439000
6        3.499306000      1.998585000     -0.280815000
6        2.381817000      2.798320000     -0.239201000
6        2.098047000     -1.450461000      0.280461000
6        1.156232000     -2.282951000     -0.186225000
1       -2.116316000      3.226596000      0.416562000
1        0.130139000      4.139604000      0.067991000
1        4.253437000      0.003741000     -0.092571000
1        4.491059000      2.434985000     -0.369178000
1        2.465534000      3.883495000     -0.262178000
6        0.945811000     -3.731903000      0.068788000
1       -0.077690000     -3.884327000      0.435605000
1        1.020065000     -4.284387000     -0.875900000
1        1.650395000     -4.165217000      0.780718000
6        3.193288000     -1.936185000      1.190876000
1        4.144108000     -2.068758000      0.657406000
1        3.376861000     -1.218819000      1.998773000
1        2.952544000     -2.897572000      1.650336000
6       -4.295880000     -1.455609000      0.066660000
1       -4.744607000     -1.344050000      1.061272000
1       -5.021299000     -1.069553000     -0.660374000
1       -4.150519000     -2.519690000     -0.131465000
6       -3.989202000      1.485475000      0.516344000
1       -4.164837000      2.223326000     -0.277736000
1       -4.911315000      0.911684000      0.632138000
1       -3.836098000      2.046908000      1.446514000
62
R
6       -3.978263000      3.435408000      1.527039000
6       -4.085734000      2.990964000      0.221044000
6       -3.020815000      2.337390000     -0.416359000
6       -1.809055000      2.127354000      0.293773000
6       -1.716645000      2.590774000      1.614977000
6       -2.785630000      3.232269000      2.223384000
6       -3.152113000      1.882982000     -1.781430000
6       -2.136080000      1.255512000     -2.416279000
6       -0.886417000      0.952711000     -1.757033000
6       -0.734528000      1.380162000     -0.369623000
6        0.585448000      1.207125000      0.238297000
7        1.173529000     -0.013360000     -0.321701000
8        1.086002000      1.758626000      1.201706000
16       2.417126000     -0.104091000     -1.258064000
8        2.462331000      0.447477000     -2.620792000
6        2.679065000     -1.863515000     -1.364416000
6        3.840382000      0.499719000     -0.367571000
6        4.922139000      0.970470000     -1.106640000
6        6.058140000      1.393173000     -0.426320000
6        6.094206000      1.343409000      0.964685000
6        4.997430000      0.880504000      1.687326000
6        3.854240000      0.451654000      1.023880000
1       -4.814784000      3.940965000      2.004737000
1       -5.008365000      3.145753000     -0.338457000
1       -0.783712000      2.450550000      2.153480000
1       -2.687493000      3.581299000      3.249345000
1       -4.089592000      2.090533000     -2.297623000
1       -2.241565000      0.966449000     -3.462005000
1       -0.006242000      0.926164000     -2.400102000
1        3.566655000     -2.026407000     -1.980867000
1        2.803302000     -2.270267000     -0.357963000
1        1.781636000     -2.271333000     -1.841748000
1        4.855881000      1.015788000     -2.191045000
1        6.913254000      1.768018000     -0.982783000
1        6.984158000      1.678097000      1.492507000
1        5.026663000      0.864812000      2.773463000
1        2.965672000      0.131097000      1.562996000
44      -0.835999000     -0.771217000     -0.465997000
6       -2.889221000     -1.329884000     -0.001937000
6       -2.136079000     -1.412933000      1.207078000
6       -2.536653000     -2.085232000     -1.159089000
1       -2.424264000     -0.781220000      2.045903000
6       -0.983550000     -2.227761000      1.282403000
6       -1.394727000     -2.918881000     -1.092826000
1       -1.079072000     -3.487582000     -1.964295000
6       -0.609772000     -2.916025000      0.090882000
1        0.328169000     -3.473477000      0.099175000
1       -3.730601000     -0.640963000     -0.059161000
6       -3.364162000     -1.989898000     -2.399882000
1       -2.769400000     -2.223583000     -3.289944000
1       -4.208454000     -2.689903000     -2.360584000
1       -3.771026000     -0.978535000     -2.514552000
6       -0.094234000     -2.304534000      2.498829000
1        0.927131000     -2.488770000      2.120201000
6       -0.056094000     -1.016796000      3.311095000
1       -1.030444000     -0.803928000      3.770854000
1        0.667201000     -1.110103000      4.129932000
1        0.228930000     -0.151787000      2.697993000
6       -0.502787000     -3.490408000      3.371934000
1        0.172420000     -3.603915000      4.228795000
1       -1.518711000     -3.339468000      3.761340000
1       -0.499748000     -4.428861000      2.804562000






















