( CALCULATION OF VIBRATION ENERGIES FOR ABCD MOLECULE ) ( HOOH from QZ-CCSD(T) ab initio calcs. ) ( 2014, oleg PES ) mem 360 gb PTorder 0 (Max Perturbation order ) KinOrder 6 (Max order in the kinetic energy expansion) PotOrder 8 (Max order in the potential energy expansion) Natoms 4 (Number of atoms) Nmodes 6 (Number of modes = 3*Natoms-6) (ACTIVE SPACE CUTOFFS:) PRIMITIVES Npolyads 38 (how many polyads we calculate) enercut 24000. (energy cut in the primitive matrix for the diagonalization) numerpoints 35000 END CONTRACTION Npolyads 38 (how many polyads we calculate) enercut 24000. (energy cut in the primitive matrix for the diagonalization) degeneracy 1e-4 (threashold to define degeneracy) sample_points 20 sample_attempts 1000 symm_toler 1e-4 cluster 1.0 model j=0 END SYMGROUP D2h(M) DIAGONALIZER SYEV enermax 18000 end IRON-OUT verbose 4 dstep 5.e-3 (finite difference element for each mode ) COORDS linear (type of the internal coordinates: linear or local) TRANSFORM r-alpha-tau MOLTYPE ABCD (Identifying type of the Molecule (e.g. XY3)) MOLECULE HOOH (Identifying the Molecule, e.g. PH3, BiH3 - optional) REFER-CONF NON-RIGID ZMAT O 0 0 0 0 15.99491463 O 1 0 0 0 15.99491463 H 1 2 0 0 1.00782505 H 2 1 3 2 1.00782505 end (type chi_kin chi_pot) BASIS 0,'JKtau', Jrot 1 1, 'numerov', 'linear', 'morse', range 0,12 , resc 3.0,points 1000,borders -0.5, 1.0 2, 'numerov', 'linear', 'morse', range 0, 7 , resc 5.6,points 1000,borders -0.4, 1.2 2, 'numerov', 'linear', 'morse', range 0, 7 , resc 5.6,points 1000,borders -0.4, 1.2 3, 'numerov', 'linear', 'linear',range 0,14 , resc 4.0,points 1000,borders -1.4, 1.4 3, 'numerov', 'linear', 'linear',range 0,14 , resc 4.0,points 1000,borders -1.4, 1.4 4, 'numerov', 'linear', 'linear',range 0,38 , resc 1.0,points 6000,borders 0.00000d0, 720.0000d0 deg , periodic 2 END CHECK_POINT HAMILTONIAN none ascii kinetic read potential read external none basis_set read CONTRACT read matelem read split extmatelem none EIGENFUNC save END EQUILIBRIUM re1 0 1.45577728 re2 0 0.96253006 re3 0 0.96253006 alphae1 0 101.08194717 DEG alphae2 0 101.08194717 DEG taue 0 112.46000000 DEG end SPECPARAM beta1 0 1.00000000 beta2 0 1.00000000 beta3 0 1.00000000 END POTEN NPARAM 166 POT_TYPE POTEN_H2O2_KOPUT_UNIQUE COEFF powers (powers or list) (oo oh1 oh2 h1oo h2oo rho) f000000 0 0 0 0 0 0 1 0.14557772800000E+01 f000000 0 0 0 0 0 0 1 0.96253006000000E+00 f000000 0 0 0 0 0 0 1 0.10108194717000E+03 f000000 0 0 0 0 0 0 1 0.11246000000000E+03 f000000 0 0 0 0 0 0 1 0.39611300000000E-02 f000001 0 0 0 0 0 1 1 0.48279121261621E-02 f000002 0 0 0 0 0 2 1 0.31552076592194E-02 f000003 0 0 0 0 0 3 1 0.27380895575892E-03 f000004 0 0 0 0 0 4 1 0.53200000000000E-04 f000005 0 0 0 0 0 5 1 0.10460000000000E-04 f000006 0 0 0 0 0 6 1 0.19800000000000E-05 f200000 2 0 0 0 0 0 1 0.10745581426665E+01 f002000 0 0 2 0 0 0 1 0.85571687291095E+00 f000200 0 0 0 2 0 0 1 0.11076611551557E+00 f101000 1 0 1 0 0 0 1 -0.38453650000000E-01 f100100 1 0 0 1 0 0 1 0.18422191000000E+00 f011000 0 1 1 0 0 0 1 0.34113000000000E-03 f001100 0 0 1 1 0 0 1 -0.66818400000000E-02 f001010 0 0 1 0 1 0 1 -0.19609200000000E-02 f000110 0 0 0 1 1 0 1 0.17456000000000E-01 f300000 3 0 0 0 0 0 1 -0.11834501500000E+01 f003000 0 0 3 0 0 0 1 -0.23754920000000E+00 f000300 0 0 0 3 0 0 1 -0.26151090000000E-01 f201000 2 0 1 0 0 0 1 -0.15446390000000E+00 f200100 2 0 0 1 0 0 1 -0.35538073000000E+00 f102000 1 0 2 0 0 0 1 0.79259280000000E-01 f100200 1 0 0 2 0 0 1 -0.26791829000000E+00 f021000 0 2 1 0 0 0 1 -0.40836900000000E-02 f001200 0 0 1 2 0 0 1 -0.19328730000000E-01 f002100 0 0 2 1 0 0 1 -0.11077720000000E-01 f001020 0 0 1 0 2 0 1 -0.81558400000000E-02 f002010 0 0 2 0 1 0 1 0.33558100000000E-02 f000120 0 0 0 1 2 0 1 -0.13536850000000E-01 f111000 1 1 1 0 0 0 1 0.12972570000000E-01 f101100 1 0 1 1 0 0 1 -0.74514420000000E-01 f101010 1 0 1 0 1 0 1 -0.33759140000000E-01 f100110 1 0 0 1 1 0 1 -0.16765490000000E-01 f011100 0 1 1 1 0 0 1 -0.49502200000000E-02 f001110 0 0 1 1 1 0 1 -0.45515500000000E-02 f400000 4 0 0 0 0 0 1 -0.91114371000000E+00 f004000 0 0 4 0 0 0 1 -0.38794237000000E+00 f000400 0 0 0 4 0 0 1 -0.50366700000000E-02 f202000 2 0 2 0 0 0 1 -0.46529063000000E+00 f200200 2 0 0 2 0 0 1 0.74993510000000E-01 f022000 0 2 2 0 0 0 1 -0.79755000000000E-02 f002200 0 0 2 2 0 0 1 -0.40578730000000E-01 f000220 0 0 0 2 2 0 1 0.36418700000000E-02 f301000 3 0 1 0 0 0 1 0.47679811000000E+00 f300100 3 0 0 1 0 0 1 -0.41694250000000E+00 f003100 0 0 3 1 0 0 1 -0.64173060000000E-01 f103000 1 0 3 0 0 0 1 0.26181548000000E+00 f100300 1 0 0 3 0 0 1 0.10331249000000E+00 f031000 0 3 1 0 0 0 1 -0.16764600000000E-01 f001300 0 0 1 3 0 0 1 0.49720820000000E-01 f001030 0 0 1 0 3 0 1 0.35349000000000E-02 f000130 0 0 0 1 3 0 1 0.45131200000000E-02 f211000 2 1 1 0 0 0 1 -0.54438100000000E-01 f201100 2 0 1 1 0 0 1 0.66395350000000E-01 f201010 2 0 1 0 1 0 1 0.38113530000000E-01 f200110 2 0 0 1 1 0 1 -0.91849510000000E-01 f002110 0 0 2 1 1 0 1 -0.15942730000000E-01 f101200 1 0 1 2 0 0 1 0.13766990000000E-01 f001120 0 0 1 1 2 0 1 -0.13437230000000E-01 f001210 0 0 1 2 1 0 1 -0.67094900000000E-02 f500000 5 0 0 0 0 0 1 -0.73372711000000E+00 f005000 0 0 5 0 0 0 1 -0.30456872000000E+00 f000500 0 0 0 5 0 0 1 0.58607400000000E-02 f000600 0 0 0 6 0 0 1 -0.55207300000000E-02 f000410 0 0 0 4 1 0 1 0.28076700000000E-02 f000320 0 0 0 3 2 0 1 0.67296800000000E-02 f100400 1 0 0 4 0 0 1 0.68425950000000E-01 f200300 2 0 0 3 0 0 1 0.41471350000000E-01 f001400 0 0 1 4 0 0 1 -0.51908230000000E-01 f002300 0 0 2 3 0 0 1 0.41444370000000E-01 f100001 1 0 0 0 0 1 1 -0.17058455471451E-01 f001001 0 0 1 0 0 1 1 0.35160314406735E-03 f000101 0 0 0 1 0 1 1 -0.11299103381864E-01 f200001 2 0 0 0 0 1 1 0.25198741616507E-01 f002001 0 0 2 0 0 1 1 -0.89694449495066E-02 f000201 0 0 0 2 0 1 1 0.51235742815365E-02 f101001 1 0 1 0 0 1 1 0.26460300000000E-02 f100101 1 0 0 1 0 1 1 0.18589300000000E-01 f011001 0 1 1 0 0 1 1 0.51231000000000E-02 f001101 0 0 1 1 0 1 1 -0.25445463464196E-01 f001011 0 0 1 0 1 1 1 0.90838773282894E-02 f000111 0 0 0 1 1 1 1 -0.12281838234907E-01 f300001 3 0 0 0 0 1 1 0.36741900000000E-02 f003001 0 0 3 0 0 1 1 -0.96147900000000E-02 f000301 0 0 0 3 0 1 1 -0.11350800000000E-02 f201001 2 0 1 0 0 1 1 0.10290050000000E-01 f200101 2 0 0 1 0 1 1 -0.37390580000000E-01 f100201 1 0 0 2 0 1 1 -0.70580400000000E-02 f021001 0 2 1 0 0 1 1 0.74184500000000E-02 f001201 0 0 1 2 0 1 1 0.41813300000000E-02 f001021 0 0 1 0 2 1 1 -0.55462000000000E-02 f000121 0 0 0 1 2 1 1 -0.20437810000000E-01 f111001 1 1 1 0 0 1 1 -0.24268490000000E-01 f001111 0 0 1 1 1 1 1 0.15269000000000E-02 f000401 0 0 0 4 0 1 1 0.50652000000000E-03 f000501 0 0 0 5 0 1 1 0.14971600000000E-02 f100301 1 0 0 3 0 1 1 0.22296840000000E-01 f200201 2 0 0 2 0 1 1 0.71883950000000E-01 f000131 0 0 0 1 3 1 1 0.16433490000000E-01 f000221 0 0 0 2 2 1 1 0.18156780000000E-01 f001301 0 0 1 3 0 1 1 0.16000590000000E-01 f001031 0 0 1 0 3 1 1 0.73170000000000E-02 f002201 0 0 2 2 0 1 1 0.26711590000000E-01 f002021 0 0 2 0 2 1 1 0.15553630000000E-01 f201101 2 0 1 1 0 1 1 -0.13026695000000E+00 f102101 1 0 2 1 0 1 1 0.73438920000000E-01 f101201 1 0 1 2 0 1 1 -0.88676410000000E-01 f100002 1 0 0 0 0 2 1 -0.11154630681622E-01 f001002 0 0 1 0 0 2 1 0.18116374839690E-02 f000102 0 0 0 1 0 2 1 -0.15952632140282E-02 f200002 2 0 0 0 0 2 1 0.19755890000000E-01 f002002 0 0 2 0 0 2 1 0.41103800000000E-02 f000202 0 0 0 2 0 2 1 0.30044800000000E-02 f101002 1 0 1 0 0 2 1 -0.74139300000000E-02 f100102 1 0 0 1 0 2 1 0.34794600000000E-02 f011002 0 1 1 0 0 2 1 -0.36795000000000E-03 f001102 0 0 1 1 0 2 1 0.25041900000000E-02 f001012 0 0 1 0 1 2 1 -0.16805400000000E-02 f000112 0 0 0 1 1 2 1 0.91412200000000E-02 f300002 3 0 0 0 0 2 1 -0.20252150000000E-01 f003002 0 0 3 0 0 2 1 0.92842300000000E-02 f000302 0 0 0 3 0 2 1 -0.59340600000000E-02 f000212 0 0 0 2 1 2 1 -0.12299210000000E-01 f100202 1 0 0 2 0 2 1 0.83434100000000E-02 f201002 2 0 1 0 0 2 1 0.37508560000000E-01 f102002 1 0 2 0 0 2 1 -0.43399580000000E-01 f000402 0 0 0 4 0 2 1 0.45929600000000E-02 f000132 0 0 0 1 3 2 1 0.36364200000000E-02 f000222 0 0 0 2 2 2 1 0.98765600000000E-02 f002102 0 0 2 1 0 2 1 0.14343780000000E-01 f001202 0 0 1 2 0 2 1 0.72217000000000E-03 f001022 0 0 1 0 2 2 1 -0.15917000000000E-02 f101102 1 0 1 1 0 2 1 -0.39620680000000E-01 f101012 1 0 1 0 1 2 1 -0.17337430000000E-01 f100302 1 0 0 3 0 2 1 0.26631060000000E-01 f100003 1 0 0 0 0 3 1 -0.18835000000000E-02 f001003 0 0 1 0 0 3 1 0.52211000000000E-03 f000103 0 0 0 1 0 3 1 -0.89434000000000E-03 f200003 2 0 0 0 0 3 1 0.48212500000000E-02 f002003 0 0 2 0 0 3 1 0.31285000000000E-03 f000203 0 0 0 2 0 3 1 0.10312600000000E-02 f000113 0 0 0 1 1 3 1 0.22453000000000E-02 f300003 3 0 0 0 0 3 1 -0.36692200000000E-02 f000303 0 0 0 3 0 3 1 -0.33319000000000E-03 f000123 0 0 0 1 2 3 1 -0.31914400000000E-02 f100103 1 0 0 1 0 3 1 0.44701700000000E-02 f001103 0 0 1 1 0 3 1 -0.14780600000000E-02 f001013 0 0 1 0 1 3 1 -0.85493000000000E-03 f200103 2 0 0 1 0 3 1 -0.11014260000000E-01 f100004 1 0 0 0 0 4 1 -0.43148000000000E-03 f001004 0 0 1 0 0 4 1 0.13592000000000E-03 f000104 0 0 0 1 0 4 1 -0.19174000000000E-03 f200004 2 0 0 0 0 4 1 0.12234500000000E-02 f000204 0 0 0 2 0 4 1 0.26701000000000E-03 f000114 0 0 0 1 1 4 1 0.54541000000000E-03 f100104 1 0 0 1 0 4 1 0.57269000000000E-03 f100005 1 0 0 0 0 5 1 -0.90760000000000E-04 f001005 0 0 1 0 0 5 1 0.22730000000000E-04 f000105 0 0 0 1 0 5 1 -0.40750000000000E-04 f100000 1 0 0 0 0 0 1 0.00000000000000E+00 f010000 0 1 0 0 0 0 1 0.00000000000000E+00 f000100 0 0 0 1 0 0 1 -0.16482432407665E-03 end external rank 3 NPARAM 136 96 98 DMS_TYPE HOOH_MB COEFF powers (powers or list) COORDS linear Order 6 6 6 parameters re1 0 0 0 0 0 0 0 1.45538654 re2 0 0 0 0 0 0 0 0.96257063 alphae 0 0 0 0 0 0 0 101.08307909 beta1 0 0 0 0 0 0 0 1.00000000 beta2 0 0 0 0 0 0 0 1.00000000 xxxxx 0 0 0 0 0 0 0 0.00000000 mu000000 0 0 0 0 0 0 7 3.11323258 mu000001 0 0 0 0 0 1 6 -0.05725254 mu000002 0 0 0 0 0 2 5 -0.00374176 mu000003 0 0 0 0 0 3 4 -0.00488296 mu000004 0 0 0 0 0 4 3 -0.00028748 mu000100 0 0 0 1 0 0 6 -0.06519172 mu000101 0 0 0 1 0 1 5 0.05757449 mu000102 0 0 0 1 0 2 4 0.06732631 mu000103 0 0 0 1 0 3 3 -0.00493102 mu000104 0 0 0 1 0 4 2 0.02908091 mu010000 0 1 0 0 0 0 6 0.66972783 mu010001 0 1 0 0 0 1 5 -0.09558179 mu010002 0 1 0 0 0 2 4 0.01241822 mu010003 0 1 0 0 0 3 3 -0.01953755 mu100000 1 0 0 0 0 0 6 -0.10469703 mu100001 1 0 0 0 0 1 5 0.04067681 mu100002 1 0 0 0 0 2 4 -0.08533543 mu100003 1 0 0 0 0 3 3 0.00622996 mu000110 0 0 0 1 1 0 5 0.01317342 mu000111 0 0 0 1 1 1 4 -0.19646326 mu000112 0 0 0 1 1 2 3 -0.01341410 mu000113 0 0 0 1 1 3 2 -0.12932463 mu000200 0 0 0 2 0 0 5 -0.68879600 mu000201 0 0 0 2 0 1 4 -0.04598872 mu000202 0 0 0 2 0 2 3 -0.01285652 mu010010 0 1 0 0 1 0 5 0.01416099 mu010011 0 1 0 0 1 1 4 0.04106741 mu010012 0 1 0 0 1 2 3 0.10795571 mu010013 0 1 0 0 1 3 2 0.05292923 mu010100 0 1 0 1 0 0 5 -0.61828349 mu010101 0 1 0 1 0 1 4 0.13389777 mu010102 0 1 0 1 0 2 3 0.38095902 mu011000 0 1 1 0 0 0 5 -0.20605635 mu011001 0 1 1 0 0 1 4 0.04621385 mu011002 0 1 1 0 0 2 3 0.03967813 mu011003 0 1 1 0 0 3 2 0.12335973 mu020000 0 2 0 0 0 0 5 -0.86679647 mu020001 0 2 0 0 0 1 4 -0.03897074 mu020002 0 2 0 0 0 2 3 0.19534642 mu100100 1 0 0 1 0 0 5 -0.24881047 mu100101 1 0 0 1 0 1 4 -0.03584446 mu100102 1 0 0 1 0 2 3 -0.21995268 mu110000 1 1 0 0 0 0 5 0.29100294 mu110001 1 1 0 0 0 1 4 -0.07930690 mu110002 1 1 0 0 0 2 3 -0.38051433 mu200000 2 0 0 0 0 0 5 -0.49042536 mu200001 2 0 0 0 0 1 4 0.11502829 mu200002 2 0 0 0 0 2 3 0.23959602 mu200003 2 0 0 0 0 3 2 0.03259108 mu000210 0 0 0 2 1 0 4 -0.03530355 mu000211 0 0 0 2 1 1 3 0.04035866 mu000300 0 0 0 3 0 0 4 0.03983645 mu000301 0 0 0 3 0 1 3 -0.03686978 mu010020 0 1 0 0 2 0 4 -0.00601249 mu010110 0 1 0 1 1 0 4 -0.25677543 mu010111 0 1 0 1 1 1 3 -0.03422547 mu010200 0 1 0 2 0 0 4 -0.27046970 mu010201 0 1 0 2 0 1 3 -0.32675849 mu011100 0 1 1 1 0 0 4 0.01287281 mu011101 0 1 1 1 0 1 3 -0.66922498 mu020010 0 2 0 0 1 0 4 0.32272882 mu020011 0 2 0 0 1 1 3 0.05043970 mu020100 0 2 0 1 0 0 4 -0.78863574 mu020101 0 2 0 1 0 1 3 0.36961253 mu021000 0 2 1 0 0 0 4 -0.04931224 mu021001 0 2 1 0 0 1 3 0.43165551 mu030000 0 3 0 0 0 0 4 -0.82103070 mu030001 0 3 0 0 0 1 3 -0.11976498 mu030002 0 3 0 0 0 2 2 0.40387350 mu100110 1 0 0 1 1 0 4 -0.18321498 mu100200 1 0 0 2 0 0 4 -0.22652965 mu100201 1 0 0 2 0 1 3 0.09645058 mu100202 1 0 0 2 0 2 2 0.06808583 mu110010 1 1 0 0 1 0 4 0.31330618 mu110011 1 1 0 0 1 1 3 0.28209665 mu110100 1 1 0 1 0 0 4 1.01250733 mu110101 1 1 0 1 0 1 3 -0.52025169 mu111000 1 1 1 0 0 0 4 -0.72697922 mu111001 1 1 1 0 0 1 3 -1.99745681 mu120000 1 2 0 0 0 0 4 3.38713970 mu120001 1 2 0 0 0 1 3 -0.23356601 mu120002 1 2 0 0 0 2 2 -1.05366093 mu200100 2 0 0 1 0 0 4 -0.99727142 mu200101 2 0 0 1 0 1 3 0.06007801 mu210000 2 1 0 0 0 0 4 -2.34033777 mu210001 2 1 0 0 0 1 3 1.00142240 mu210002 2 1 0 0 0 2 2 0.61168153 mu300000 3 0 0 0 0 0 4 1.14058942 mu300001 3 0 0 0 0 1 3 -0.54014076 mu300002 3 0 0 0 0 2 2 -0.10147091 mu000220 0 0 0 2 2 0 3 -0.25640603 mu000221 0 0 0 2 2 1 2 0.18985102 mu000310 0 0 0 3 1 0 3 0.00911805 mu000400 0 0 0 4 0 0 3 0.11191731 mu010030 0 1 0 0 3 0 3 -0.23500094 mu010120 0 1 0 1 2 0 3 -0.87213206 mu010121 0 1 0 1 2 1 2 -0.06610070 mu010210 0 1 0 2 1 0 3 0.41333960 mu010211 0 1 0 2 1 1 2 -0.41744685 mu010300 0 1 0 3 0 0 3 0.50714422 mu011110 0 1 1 1 1 0 3 0.66781535 mu011200 0 1 1 2 0 0 3 -0.14765702 mu011201 0 1 1 2 0 1 2 -1.46064200 mu020020 0 2 0 0 2 0 3 0.66248257 mu020110 0 2 0 1 1 0 3 0.78197761 mu020200 0 2 0 2 0 0 3 1.07151268 mu021010 0 2 1 0 1 0 3 -1.08262959 mu021100 0 2 1 1 0 0 3 0.81091094 mu022000 0 2 2 0 0 0 3 1.21289154 mu030100 0 3 0 1 0 0 3 -0.71608150 mu031000 0 3 1 0 0 0 3 -0.34547695 mu040000 0 4 0 0 0 0 3 -3.64075710 mu100210 1 0 0 2 1 0 3 -0.15318762 mu110020 1 1 0 0 2 0 3 0.25121282 mu110200 1 1 0 2 0 0 3 -1.72380619 mu120010 1 2 0 0 1 0 3 1.85213801 mu120100 1 2 0 1 0 0 3 2.03055777 mu121000 1 2 1 0 0 0 3 -1.18873626 mu130000 1 3 0 0 0 0 3 5.47045505 mu200110 2 0 0 1 1 0 3 0.64914351 mu200200 2 0 0 2 0 0 3 0.15522816 mu200201 2 0 0 2 0 1 2 -0.29452031 mu210010 2 1 0 0 1 0 3 -1.17440328 mu210100 2 1 0 1 0 0 3 -1.73761622 mu211000 2 1 1 0 0 0 3 4.30733144 mu220000 2 2 0 0 0 0 3 -7.53346655 mu300100 3 0 0 1 0 0 3 0.88799794 mu310000 3 1 0 0 0 0 3 3.30274759 mu400000 4 0 0 0 0 0 3 -0.94732772 mu400001 4 0 0 0 0 1 2 0.97116059 re1 0 0 0 0 0 0 0 1.45538654 re2 0 0 0 0 0 0 0 0.96257063 alphae 0 0 0 0 0 0 0 101.08307909 beta1 0 0 0 0 0 0 0 1.00000000 beta2 0 0 0 0 0 0 0 1.00000000 xxxxx 0 0 0 0 0 0 0 0.00000000 mu000100 0 0 0 1 0 0 6 -0.11522003 mu000101 0 0 0 1 0 1 5 -0.02375606 mu000102 0 0 0 1 0 2 4 0.03082497 mu000103 0 0 0 1 0 3 3 -0.00219756 mu010000 0 1 0 0 0 0 6 0.76976429 mu010001 0 1 0 0 0 1 5 -0.15248656 mu010002 0 1 0 0 0 2 4 -0.00232759 mu010003 0 1 0 0 0 3 3 -0.01448175 mu000200 0 0 0 2 0 0 5 -0.76042935 mu000201 0 0 0 2 0 1 4 -0.03411672 mu000202 0 0 0 2 0 2 3 0.01354047 mu010010 0 1 0 0 1 0 5 0.09530094 mu010011 0 1 0 0 1 1 4 0.03364524 mu010012 0 1 0 0 1 2 3 0.11820207 mu010100 0 1 0 1 0 0 5 -0.67449760 mu010101 0 1 0 1 0 1 4 -0.10661819 mu010102 0 1 0 1 0 2 3 0.26672582 mu020000 0 2 0 0 0 0 5 -1.00769107 mu020001 0 2 0 0 0 1 4 -0.13751556 mu020002 0 2 0 0 0 2 3 0.16040481 mu100100 1 0 0 1 0 0 5 -0.25225029 mu100101 1 0 0 1 0 1 4 0.00579598 mu100102 1 0 0 1 0 2 3 -0.07177576 mu110000 1 1 0 0 0 0 5 0.46519934 mu110001 1 1 0 0 0 1 4 0.30734947 mu110002 1 1 0 0 0 2 3 -0.06580830 mu000210 0 0 0 2 1 0 4 0.06806574 mu000211 0 0 0 2 1 1 3 -0.08074635 mu000300 0 0 0 3 0 0 4 0.13660951 mu000301 0 0 0 3 0 1 3 0.01807933 mu010020 0 1 0 0 2 0 4 0.13303812 mu010021 0 1 0 0 2 1 3 -0.04471864 mu010110 0 1 0 1 1 0 4 0.01943597 mu010111 0 1 0 1 1 1 3 -0.07227419 mu010200 0 1 0 2 0 0 4 -0.14871095 mu010201 0 1 0 2 0 1 3 -0.11233986 mu011100 0 1 1 1 0 0 4 -0.03956400 mu011101 0 1 1 1 0 1 3 -0.23332395 mu020010 0 2 0 0 1 0 4 0.13968980 mu020011 0 2 0 0 1 1 3 0.06905333 mu020100 0 2 0 1 0 0 4 -1.06053687 mu021000 0 2 1 0 0 0 4 -0.30624242 mu021001 0 2 1 0 0 1 3 -0.18659308 mu030000 0 3 0 0 0 0 4 -0.75249889 mu030001 0 3 0 0 0 1 3 -0.19823128 mu100200 1 0 0 2 0 0 4 -0.27320023 mu100201 1 0 0 2 0 1 3 -0.02051666 mu110010 1 1 0 0 1 0 4 -0.23818000 mu110011 1 1 0 0 1 1 3 0.15470924 mu110100 1 1 0 1 0 0 4 1.26292533 mu110101 1 1 0 1 0 1 3 0.50985133 mu120000 1 2 0 0 0 0 4 3.09315269 mu120001 1 2 0 0 0 1 3 0.07077282 mu120002 1 2 0 0 0 2 2 -1.40564817 mu200100 2 0 0 1 0 0 4 -1.04538494 mu200101 2 0 0 1 0 1 3 -0.20183396 mu210000 2 1 0 0 0 0 4 -2.71229785 mu210001 2 1 0 0 0 1 3 -0.58355321 mu000310 0 0 0 3 1 0 3 0.01825848 mu000400 0 0 0 4 0 0 3 -0.00970595 mu010030 0 1 0 0 3 0 3 -0.28103103 mu010120 0 1 0 1 2 0 3 -0.60532691 mu010210 0 1 0 2 1 0 3 0.25118413 mu010300 0 1 0 3 0 0 3 0.75936673 mu020020 0 2 0 0 2 0 3 0.34949255 mu020110 0 2 0 1 1 0 3 0.30731813 mu020200 0 2 0 2 0 0 3 1.10419090 mu021010 0 2 1 0 1 0 3 0.83479701 mu021100 0 2 1 1 0 0 3 -0.93370246 mu030010 0 3 0 0 1 0 3 -0.20615505 mu030100 0 3 0 1 0 0 3 -0.82575267 mu031000 0 3 1 0 0 0 3 -0.59532924 mu040000 0 4 0 0 0 0 3 -4.34413862 mu100210 1 0 0 2 1 0 3 -0.48569806 mu100300 1 0 0 3 0 0 3 -0.54301971 mu110020 1 1 0 0 2 0 3 -0.39431376 mu110110 1 1 0 1 1 0 3 -1.19671195 mu110200 1 1 0 2 0 0 3 -1.69167282 mu111100 1 1 1 1 0 0 3 2.04664491 mu120010 1 2 0 0 1 0 3 0.50524322 mu120100 1 2 0 1 0 0 3 1.51416211 mu121000 1 2 1 0 0 0 3 2.19684489 mu130000 1 3 0 0 0 0 3 5.77563945 mu130001 1 3 0 0 0 1 2 2.58525088 mu200200 2 0 0 2 0 0 3 0.51488338 mu210010 2 1 0 0 1 0 3 -0.45863881 mu210100 2 1 0 1 0 0 3 -2.73935904 mu220000 2 2 0 0 0 0 3 -7.59674775 mu300100 3 0 0 1 0 0 3 1.41981271 mu310000 3 1 0 0 0 0 3 4.69021274 re1 0 0 0 0 0 0 0 1.45538654 re2 0 0 0 0 0 0 0 0.96257063 alphae 0 0 0 0 0 0 0 101.08307909 beta1 0 0 0 0 0 0 0 1.00000000 beta2 0 0 0 0 0 0 0 1.00000000 xxxxx 0 0 0 0 0 0 0 0.00000000 mu000100 0 0 0 1 0 0 6 1.00316911 mu000101 0 0 0 1 0 1 5 -0.10164359 mu000102 0 0 0 1 0 2 4 0.02330392 mu000103 0 0 0 1 0 3 3 -0.00063098 mu010000 0 1 0 0 0 0 6 0.34791684 mu010001 0 1 0 0 0 1 5 -0.09454784 mu010002 0 1 0 0 0 2 4 0.10391333 mu010003 0 1 0 0 0 3 3 -0.00481751 mu000200 0 0 0 2 0 0 5 -0.45075727 mu000201 0 0 0 2 0 1 4 -0.02659622 mu000202 0 0 0 2 0 2 3 0.04816039 mu000203 0 0 0 2 0 3 3 -0.04364413 mu010010 0 1 0 0 1 0 5 0.09557868 mu010011 0 1 0 0 1 1 4 -0.27244975 mu010012 0 1 0 0 1 2 3 0.03489730 mu010100 0 1 0 1 0 0 5 1.32483215 mu010101 0 1 0 1 0 1 4 -0.19250802 mu010102 0 1 0 1 0 2 3 0.28043142 mu020000 0 2 0 0 0 0 5 -0.91524129 mu020001 0 2 0 0 0 1 4 -0.08021399 mu020002 0 2 0 0 0 2 3 0.24305931 mu100100 1 0 0 1 0 0 5 -0.19449900 mu100101 1 0 0 1 0 1 4 -0.04796322 mu100102 1 0 0 1 0 2 3 -0.19651273 mu100103 1 0 0 1 0 3 2 -0.06081596 mu110000 1 1 0 0 0 0 5 1.74767461 mu110001 1 1 0 0 0 1 4 0.29884672 mu110002 1 1 0 0 0 2 3 -0.41099352 mu000210 0 0 0 2 1 0 4 -0.01367444 mu000211 0 0 0 2 1 1 3 -0.04244129 mu000300 0 0 0 3 0 0 4 0.13607568 mu000301 0 0 0 3 0 1 3 0.05224504 mu010020 0 1 0 0 2 0 4 -0.01776867 mu010021 0 1 0 0 2 1 3 0.12170117 mu010110 0 1 0 1 1 0 4 0.04795932 mu010111 0 1 0 1 1 1 3 -0.43963040 mu010200 0 1 0 2 0 0 4 0.15995803 mu011100 0 1 1 1 0 0 4 -0.39275930 mu011101 0 1 1 1 0 1 3 0.16872709 mu020010 0 2 0 0 1 0 4 0.03388670 mu020011 0 2 0 0 1 1 3 -0.18335040 mu020100 0 2 0 1 0 0 4 -0.97822716 mu020101 0 2 0 1 0 1 3 -0.30380339 mu021000 0 2 1 0 0 0 4 -0.15874877 mu021001 0 2 1 0 0 1 3 -0.32339796 mu030000 0 3 0 0 0 0 4 -0.42754142 mu030001 0 3 0 0 0 1 3 -0.03697434 mu100200 1 0 0 2 0 0 4 -0.26142242 mu100201 1 0 0 2 0 1 3 0.05342647 mu110010 1 1 0 0 1 0 4 -0.46510653 mu110011 1 1 0 0 1 1 3 1.44170751 mu110100 1 1 0 1 0 0 4 0.73423954 mu110101 1 1 0 1 0 1 3 1.41153046 mu120000 1 2 0 0 0 0 4 1.55430356 mu120001 1 2 0 0 0 1 3 0.37058666 mu120002 1 2 0 0 0 2 2 -1.26124837 mu200100 2 0 0 1 0 0 4 0.95014875 mu200101 2 0 0 1 0 1 3 0.20403237 mu210000 2 1 0 0 0 0 4 -3.56986187 mu210002 2 1 0 0 0 2 2 1.27621295 mu000310 0 0 0 3 1 0 3 0.06637696 mu000400 0 0 0 4 0 0 3 -0.35021651 mu010030 0 1 0 0 3 0 3 0.04372953 mu010120 0 1 0 1 2 0 3 -0.60709366 mu010210 0 1 0 2 1 0 3 -0.26561147 mu010300 0 1 0 3 0 0 3 1.18662785 mu011200 0 1 1 2 0 0 3 -0.33482447 mu020020 0 2 0 0 2 0 3 -0.49229752 mu020110 0 2 0 1 1 0 3 1.21309377 mu020200 0 2 0 2 0 0 3 0.48681736 mu021100 0 2 1 1 0 0 3 0.18993538 mu030010 0 3 0 0 1 0 3 -0.29868619 mu030100 0 3 0 1 0 0 3 -2.08278553 mu031000 0 3 1 0 0 0 3 -0.09147740 mu040000 0 4 0 0 0 0 3 -2.30539396 mu100210 1 0 0 2 1 0 3 -0.41600334 mu100300 1 0 0 3 0 0 3 -2.25027587 mu110020 1 1 0 0 2 0 3 1.44784922 mu110110 1 1 0 1 1 0 3 -4.10521619 mu110111 1 1 0 1 1 1 2 4.08587851 mu110200 1 1 0 2 0 0 3 1.27792221 mu111100 1 1 1 1 0 0 3 2.35142164 mu120010 1 2 0 0 1 0 5 -0.09123183 mu120100 1 2 0 1 0 0 3 4.35581349 mu121000 1 2 1 0 0 0 3 1.18133223 mu130000 1 3 0 0 0 0 3 2.38373068 mu200200 2 0 0 2 0 0 3 0.87293466 mu210010 2 1 0 0 1 0 3 -0.10637550 mu210100 2 1 0 1 0 0 3 -7.08724662 mu220000 2 2 0 0 0 0 3 -3.36562972 mu300100 3 0 0 1 0 0 3 3.69677224 mu310001 3 1 0 0 0 1 2 -1.47895612 end