[Molden Format]
[Molpro variables]
_NUMVAR=  806.0000000000000
_AVOGAD= 0.6022136736000000E+24
_BOLTZ= 0.1380658000000000E-22
_CLIGHT=  29979245800.00000
_EV2006= 0.3674930886769165E-01
_EV= 0.3674932534394180E-01
_ENULL= 0.8854187817000000E-11
_KJOULE= 0.3808798324128737E-03
_KJOULE/MOL= 0.3808798324128737E-03
_CM= 0.4556335267302901E-05
_CM-1= 0.4556335267302901E-05
_DEB2SI= 0.3335641000000000E-29
_AMU2AU=  1822.888390000000
_KCAL= 0.1593601117815568E-02
_KCAL/MOL= 0.1593601117815568E-02
_KELVIN2006= 0.3166828861084835E-05
_KELVIN= 0.3166814820820034E-05
_JOULE= 0.4359748200000000E-17
_HERTZ2006= 0.1519829850815779E-15
_HERTZ= 0.1519829846011223E-15
_HZ2006= 0.1519829850815779E-15
_HZ= 0.1519829846011223E-15
_JPCAL=  4.184000000000000
_PLANCK= 0.6626075540000000E-33
_TOA2006= 0.5291772490000000
_TOA= 0.5291772090000000
_TOANG2006= 0.5291772490000000
_TOANG= 0.5291772090000000
_TORAD= 0.1745329251994330E-01
_TOCM=  219474.6306700000
_TODEBYE=  2.541580000000000
_TOEV2006=  27.21139610000000
_TOE= 0.4803242000000000E-09
_TOEV=  27.21138390000000
_TOHERTZ2006=  6579683899900000.
_TOHERTZ=  6579683920700000.
_TOHZ2006=  6579683899900000.
_TOHZ=  6579683920700000.
_TOK2006=  315773.3000000000
_TOK=  315774.7000000000
_TOKCAL=  627.5096000000000
_TOKELVIN2006=  315773.3000000000
_TOKELVIN=  315774.7000000000
_TOKJ=  2625.500000000000
_TOKJOULE=  2625.500000000000
_TOKG= 0.1660565586000000E-26
_ANG2006=  1.889725988578923
_ANG=  1.889726131421507
_ANGSTROM2006=  1.889725988578923
_ANGSTROM=  1.889726131421507
_RPAREF=  0.000000000000000
_RPADISS=  0.000000000000000
_IGNORE_UNDEF=  2.000000000000000
_STRICTCHECK=  0.000000000000000
_SEW_ONEEL=  0.000000000000000
_CPPDONE=FALSE
_DKROLL_DONE=  0.000000000000000
_FOCKDONE=TRUE
_GRADONE=FALSE
_HESSDONE=FALSE
_INTDONE=TRUE
_SCFDONE=TRUE
_MODUL_CUDA=FALSE
_MODUL_SLATER=FALSE
_MODUL_MRCC=FALSE
_MODUL_NBO6=FALSE
_MODUL_NECI=TRUE
_MRCC_EXEC=
_FITC_AO_SAVED=FALSE
_FITC_MO_SAVED=FALSE
_SHARED_FS=TRUE
_LSTYP=SEWARD
_INTYP=INTS
_GEOMTYP=ZMAT
_GRADTYP=ALASKA
_DIRECT=FALSE
_DKROLL=FALSE
_DKHO= -1.000000000000000
_DKHP= -1.000000000000000
_SYNCM=  0.000000000000000
_DFTNAME=  0.000000000000000
_DFTFUNC=  0.000000000000000
_BASIS=AVTZ
_BASISSETS=
_ZSIGNX=
_ZSIGNY=
_ZSIGNZ=
_ZCENTRE=
_ZSYMEL=
_ZPLANE=
_ZUNIT=
_ZORIENT=  1.000000000000000
_CHARGE=  1.000000000000000
_SCFCHARGE=  1.000000000000000
_MCCHARGE=  1.000000000000000
_CICHARGE=  1.000000000000000
_CCCHARGE=  1.000000000000000
_NELEC=  66.00000000000000
!NELEC=  66.00000000000000
_SCFNELEC=  66.00000000000000
_MCNELEC=  66.00000000000000
_CINELEC=  66.00000000000000
_CCNELEC=  66.00000000000000
_SPIN=  66.00000000000000
!SPIN=  0.000000000000000
_SCFSPIN=  0.000000000000000
_MCSPIN=  0.000000000000000
_CISPIN=  0.000000000000000
_CCSPIN=  0.000000000000000
_STATE=  0.000000000000000
_SCFSTATE=  0.000000000000000
_MCSTATE=  0.000000000000000
_CISTATE=  0.000000000000000
_SYMMETRY=  0.000000000000000
!SYMMETRY=  0.000000000000000
_SCFSYMMETRY=  0.000000000000000
_MCSYMMETRY=  0.000000000000000
_CISYMMETRY=  0.000000000000000
_CCSYMMETRY=  0.000000000000000
_SCFSYMM=  0.000000000000000
_MCSYMM=  0.000000000000000
_CISYMM=  0.000000000000000
_CCSYMM=  0.000000000000000
_SCFSYM=  0.000000000000000
_MCSYM=  0.000000000000000
_CISYM=  0.000000000000000
_CCSYM=  0.000000000000000
_WEIGHT=  0.000000000000000
_MCWEIGHT=  0.000000000000000
_LQUANT=  0.000000000000000
_MCLQUANT=  0.000000000000000
_OPTCONV=  0.000000000000000
_QSDSTEP=  0.000000000000000
_QSDIRC=  0.000000000000000
_PROGRAM=RHF-SCF
_CPUSTEP=  44.48000000000002
_SYSSTEP=  6.279999999999998
_WALLSTEP=  137.0600000000000
!PERT=  137.0600000000000
!DFMP2=  137.0600000000000
!DFSCF=  0.000000000000000
!DFHFENERG=  0.000000000000000
!SCSGRD=  0.000000000000000
_ATCHARGE=  0.000000000000000
_BASINP=  610.0000000000000
_CARTESIAN=TRUE
_CFIT=TRUE
_CFIT_FRED=TRUE
_CFIT_FRED_THR=TRUE
_CHII2=TRUE
_CHIRS=TRUE
_COEFF=TRUE
_CPU2IDX_CFIT=TRUE
_CPU3IDX_CFIT=TRUE
_CPUASMBL_CFIT=TRUE
_CPUBLAS1=TRUE
_CPUBLAS2=TRUE
_CPUBLAS3=TRUE
_CPUINT_DTRAF=TRUE
_CPUSOLVE_CFIT=TRUE
_CPUTOT=  246.2900000000000
_CPUTR1_CFIT=  246.2900000000000
_CPUTR2_CFIT=  246.2900000000000
_CPUINV_CFIT=  246.2900000000000
_CPUFIT_CFIT=  246.2900000000000
_CPUTRANS_CFIT=  246.2900000000000
_CPUSCREEN_CFIT=  246.2900000000000
_CPUTRANS_DTRAF=  246.2900000000000
_CPUTRA_DTRAF=  246.2900000000000
_CPUTRIPL=  246.2900000000000
_SYSTRIPL=  246.2900000000000
_WALLTRIPL=  246.2900000000000
_CPUCCSD=  246.2900000000000
_SYSCCSD=  246.2900000000000
_WALLCCSD=  246.2900000000000
_CPUSORT=  164.4200000000000
_SYSSORT=  10.64000000000000
_WALLSORT=  263.4600000008941
_CPUF12=  263.4600000008941
_SYSF12=  263.4600000008941
_WALLF12=  263.4600000008941
_CPUF12B=  263.4600000008941
_SYSF12B=  263.4600000008941
_WALLF12B=  263.4600000008941
_CPUTRANS=  263.4600000008941
_SYSTRANS=  263.4600000008941
_WALLTRANS=  263.4600000008941
_CPU2EXT=  263.4600000008941
_CPU3EXT=  263.4600000008941
_CPU4EXT=  263.4600000008941
_WALL2EXT=  263.4600000008941
_WALL3EXT=  263.4600000008941
_WALL4EXT=  263.4600000008941
_DALTON=  263.4600000008941
_DARW=  263.4600000008941
_DECAY=  263.4600000008941
_DELE_CFIT=  263.4600000008941
_DELG_CFIT=  263.4600000008941
_DELTA=  263.4600000008941
_DFTEXFAC=  1.000000000000000
_DFTFAC=  1.000000000000000
_DFTFUN=  1.000000000000000
_DFTFUNS=  1.000000000000000
_DMEX=  1.000000000000000
_DMEY=  1.000000000000000
_DMEZ=  1.000000000000000
_DMNX=  1.000000000000000
_DMNY=  1.000000000000000
_DMNZ=  1.000000000000000
_DMSCF=  1.000000000000000
_DMSCF_Efield=  1.000000000000000
_DMSCF_I=  1.000000000000000
_DMSCF_J=  1.000000000000000
_DMSCF_K=  1.000000000000000
_DMSCF_N1=  1.000000000000000
_DMSCF_N2=  1.000000000000000
_DMSCF_NUC=  1.000000000000000
_DMSCF_T=  1.000000000000000
_DMSCF_V=  1.000000000000000
_DMX=-0.8370282245095950E-10
_DMY=  0.000000000000000
_DMZ=  0.000000000000000
_DMX_SCF=-0.8370282245095950E-10
_DMY_SCF=  0.000000000000000
_DMZ_SCF=  0.000000000000000
_DMZCOR=  0.000000000000000
_DM_RHO1=  0.000000000000000
_DM_RVAL=  0.000000000000000
_DUMMYATOMS=  0.000000000000000
_FREQUENCIES=  0.000000000000000
_EDISP=  0.000000000000000
_EEDISP=  0.000000000000000
_EINTRA=  0.000000000000000
_EINTRA_R12=  0.000000000000000
_EINTER_R12=  0.000000000000000
_EHOMO=-0.3670285768737281
_EIONIC=-0.3670285768737281
_ELUMO= 0.2863600020324949E-01
_EMP2= 0.2863600020324949E-01
_EMP2_SING= 0.2863600020324949E-01
_EMP2_TRIP= 0.2863600020324949E-01
_EMP2_SINGLES= 0.2863600020324949E-01
_EMP2_SINGLES_D= 0.2863600020324949E-01
_EMP2_SCS= 0.2863600020324949E-01
_EMP2_STRONG= 0.2863600020324949E-01
_EMP2_CLOSE= 0.2863600020324949E-01
_EMP2_WEAK= 0.2863600020324949E-01
_EMP2_DIST= 0.2863600020324949E-01
_ECSING= 0.2863600020324949E-01
_ECTRIP= 0.2863600020324949E-01
_ECSINGLES= 0.2863600020324949E-01
_EF12= 0.2863600020324949E-01
_EF12_SING= 0.2863600020324949E-01
_EF12_TRIP= 0.2863600020324949E-01
_ECSING_F12= 0.2863600020324949E-01
_ECTRIP_F12= 0.2863600020324949E-01
_EF12_RHFRELAX= 0.2863600020324949E-01
_EF12_RHFRELAX_C= 0.2863600020324949E-01
_EF12_CONVSUPPRS= 0.2863600020324949E-01
_EF12_CONVSUPPRT= 0.2863600020324949E-01
_EF12_SINGLES= 0.2863600020324949E-01
_EF12_SINGLES_C= 0.2863600020324949E-01
_EF12_SCS= 0.2863600020324949E-01
_EF12_STRONG= 0.2863600020324949E-01
_EF12_CLOSE= 0.2863600020324949E-01
_EF12_WEAK= 0.2863600020324949E-01
_EF12_DIST= 0.2863600020324949E-01
_EF12S= 0.2863600020324949E-01
_EF12S_SING= 0.2863600020324949E-01
_EF12S_TRIP= 0.2863600020324949E-01
_EF12S_SCS= 0.2863600020324949E-01
_EF12S_STRONG= 0.2863600020324949E-01
_EF12S_CLOSE= 0.2863600020324949E-01
_EF12S_WEAK= 0.2863600020324949E-01
_EF12S_DIST= 0.2863600020324949E-01
_EF12D= 0.2863600020324949E-01
_EF12D_SING= 0.2863600020324949E-01
_EF12D_TRIP= 0.2863600020324949E-01
_EF12D_SCS= 0.2863600020324949E-01
_EF12D_STRONG= 0.2863600020324949E-01
_EF12D_CLOSE= 0.2863600020324949E-01
_EF12D_WEAK= 0.2863600020324949E-01
_EF12D_DIST= 0.2863600020324949E-01
_EF12F= 0.2863600020324949E-01
_EF12F_SING= 0.2863600020324949E-01
_EF12F_TRIP= 0.2863600020324949E-01
_EF12F_SCS= 0.2863600020324949E-01
_EF12F_STRONG= 0.2863600020324949E-01
_EF12F_CLOSE= 0.2863600020324949E-01
_EF12F_WEAK= 0.2863600020324949E-01
_EF12F_DIST= 0.2863600020324949E-01
_EMP2R12_2AD= 0.2863600020324949E-01
_EMP2R12_2A= 0.2863600020324949E-01
_EMP2R12_2AP= 0.2863600020324949E-01
_EMP2R12_2SAD= 0.2863600020324949E-01
_EMP2R12_2SA= 0.2863600020324949E-01
_EMP2R12_2SAP= 0.2863600020324949E-01
_EMP2R12_2B= 0.2863600020324949E-01
_EMP2_R12= 0.2863600020324949E-01
_EMP2_R12_A= 0.2863600020324949E-01
_EMP2_R12_AP= 0.2863600020324949E-01
_EMP2_R12_AD= 0.2863600020324949E-01
_EMP2_R12_2A= 0.2863600020324949E-01
_EMP2_R12_2SA= 0.2863600020324949E-01
_EMP2_R12_2SAP= 0.2863600020324949E-01
_EMP2_R12_2SAD= 0.2863600020324949E-01
_EMP2_R12_2AP= 0.2863600020324949E-01
_EMP2_R12_DIAG= 0.2863600020324949E-01
_EMP2_R12_STRONG= 0.2863600020324949E-01
_EMP2_R12_CLOSE= 0.2863600020324949E-01
_EMP2_R12_WEAK= 0.2863600020324949E-01
_EMP2_R12_DIST= 0.2863600020324949E-01
_EMP2_R12_SING= 0.2863600020324949E-01
_EMP2_R12_TRIP= 0.2863600020324949E-01
_EMP2_R12_SCS= 0.2863600020324949E-01
_EMP2R= 0.2863600020324949E-01
_EMP3= 0.2863600020324949E-01
_EMP3R= 0.2863600020324949E-01
_EMP4= 0.2863600020324949E-01
_ENERGC= 0.2863600020324949E-01
_ENERGCL= 0.2863600020324949E-01
_ENERG_CC= 0.2863600020324949E-01
_ENERG_CV= 0.2863600020324949E-01
_ENERG_VV= 0.2863600020324949E-01
_ENERGD= 0.2863600020324949E-01
_ENERGD0= 0.2863600020324949E-01
_ENERGD1= 0.2863600020324949E-01
_ENERGD2= 0.2863600020324949E-01
_ENERGD3= 0.2863600020324949E-01
_ENERGD4= 0.2863600020324949E-01
_ENERGP= 0.2863600020324949E-01
_ENERGP0= 0.2863600020324949E-01
_ENERGP1= 0.2863600020324949E-01
_ENERGP2= 0.2863600020324949E-01
_ENERGP3= 0.2863600020324949E-01
_ENERGP4= 0.2863600020324949E-01
_ENERGR= 0.2863600020324949E-01
_ENERGRR= 0.2863600020324949E-01
_ENERGS= 0.2863600020324949E-01
_ENERGT= 0.2863600020324949E-01
_ENERGU= 0.2863600020324949E-01
_ENERGW= 0.2863600020324949E-01
_ENERGY= -527.4527301128485
_ECORR= -527.4527301128485
_ECORR_SZABO= -527.4527301128485
_ECORR_TILDE= -527.4527301128485
_ECORR_ACFDT= -527.4527301128485
_ECORR_ACFDX= -527.4527301128485
_ECORR_DBAR= -527.4527301128485
_ECORR_DBAX= -527.4527301128485
_ECORR_RCCD= -527.4527301128485
_ECORR_DRCCD= -527.4527301128485
_ECORR_SOSEX= -527.4527301128485
_ECORR_PLASM= -527.4527301128485
_ECORR_LOGM= -527.4527301128485
_ECORR_LSOX= -527.4527301128485
_ECORR_LRPA= -527.4527301128485
_ENERGY_MP= -527.4527301128485
_ECBS= -527.4527301128485
_ECBSD= -527.4527301128485
_ENUC=  422.5839437143334
_EPDIST=  422.5839437143334
_EPDIST_SING=  422.5839437143334
_EPDIST_TRIP=  422.5839437143334
_EPDIST_R12=  422.5839437143334
_EPDIST_SING_R12=  422.5839437143334
_EPDIST_TRIP_R12=  422.5839437143334
_EPSUM=  422.5839437143334
_EPSUM_R12=  422.5839437143334
_EPS1=  422.5839437143334
_EPS2=  422.5839437143334
_EPS3=  422.5839437143334
_EPS4=  422.5839437143334
_EPS5=  422.5839437143334
_EPS6=  422.5839437143334
_EPS7=  422.5839437143334
_EPS8=  422.5839437143334
_EREL=  422.5839437143334
_FLOPBLAS1=  422.5839437143334
_FLOPBLAS2=  422.5839437143334
_FLOPBLAS3=  422.5839437143334
_FLOPDGM=  422.5839437143334
_FLOPDGV=  422.5839437143334
_FLOPMXM=  422.5839437143334
_FLOPMXV=  422.5839437143334
_FREQSTEP=  422.5839437143334
!RS2GRSTATE=  422.5839437143334
!RS2GRSYM=  422.5839437143334
_GRADENERG=  422.5839437143334
_GRADEXFAC=  9999.000000000000
_GRADMETHOD=  1.000000000000000
_NMRMETHOD=  0.000000000000000
_GRADRECORD=  0.000000000000000
_VIRIAL=  0.000000000000000
_GRADX=  0.000000000000000
_GRADY=  0.000000000000000
_GRADZ=  0.000000000000000
_GRADVAR=  0.000000000000000
_GRID=  0.000000000000000
_GRID_FREEZE=  0.000000000000000
!GRID_FREEZE= -1.000000000000000
!GRIDREC= -1.000000000000000
_GRID_WEIGHT_CUT= -1.000000000000000
_GRID_BLOCKSIZE= -1.000000000000000
_GRID_SPARSITY= -1.000000000000000
_GRID_RMAX= -1.000000000000000
_GTOTAL= -1.000000000000000
_HDIA= -1.000000000000000
_HDIACI= -1.000000000000000
_HEAT= -1.000000000000000
_HTOTAL= -1.000000000000000
_INCR_CORR= -1.000000000000000
_INCR_COUNT= -1.000000000000000
_INCR_READY= -1.000000000000000
_ISCHI= -1.000000000000000
_ITERATIONS=  11.00000000000000
!INTCACHE=  11.00000000000000
_KFIT=  11.00000000000000
_LASTNELEC=  66.00000000000000
_LASTSPIN=  0.000000000000000
_LASTSYM=  1.000000000000000
_LL=  1.000000000000000
_MASSV=  1.000000000000000
_MIN_ITER=  1.000000000000000
_MIXANG=  1.000000000000000
_MIXANGCI=  1.000000000000000
_MPP_PROG=  1.000000000000000
_MSENERGY=  1.000000000000000
_NACME=  1.000000000000000
_NBAS_CFIT=  1.000000000000000
_NEWREC=  1.000000000000000
_NGRID=  1.000000000000000
_NPROC_MPP=  8.000000000000000
_NPROC_MPPX=  8.000000000000000
_NPROC_SMP=  1.000000000000000
_NUMSTEP=  0.000000000000000
_OPNUC=  0.000000000000000
_OPTCONVMX=  0.000000000000000
_OPTCONVRMS=  0.000000000000000
_OPTGRAD=  0.000000000000000
_OPTGRADMX=  0.000000000000000
_OPTGRADRMS=  0.000000000000000
_OPTRMSMAX=  0.000000000000000
_OPTSTEP=  0.000000000000000
_ORBITAL=  2100.200000000000
_PAOINT_CFIT=  2100.200000000000
_PENALTY=  2100.200000000000
_PH1INT_CFIT=  2100.200000000000
_PH1VEC_CFIT=  2100.200000000000
_PH2INT_CFIT=  2100.200000000000
_PHASE=  2100.200000000000
_PI=  3.141592653589793
_PMOINT_CFIT=  3.141592653589793
_PMOVEC_CFIT=  3.141592653589793
_POISSON_ECORR=  3.141592653589793
_POISSON_ERROR=  3.141592653589793
_POLXX=  3.141592653589793
_POLXY=  3.141592653589793
_POLXZ=  3.141592653589793
_POLYY=  3.141592653589793
_POLYZ=  3.141592653589793
_POLZZ=  3.141592653589793
_POLYX=  3.141592653589793
_POLZX=  3.141592653589793
_POLZY=  3.141592653589793
_POVINT_CFIT=  3.141592653589793
_ROOT=  3.141592653589793
_RPDIST=  3.141592653589793
_RPMIN=  3.141592653589793
_RPMAX=  3.141592653589793
_EPCON=  3.141592653589793
_ECDIAG=  3.141592653589793
_EPDIAG=  3.141592653589793
!MCACT=  3.141592653589793
!MCCLOSED=  3.141592653589793
!MCFREEZE=  3.141592653589793
!MCMS2=  3.141592653589793
!MCNEL=  3.141592653589793
!MCNSTSYM=  3.141592653589793
!MCSTATE=  3.141592653589793
!MCSYM=  3.141592653589793
!MCWEIGHT=  3.141592653589793
_SEIG_MIN= 0.1147087165449247E-06
_SEWPROP=TRUE
_SMAT=TRUE
_SMATCI=TRUE
_SSQUARED=TRUE
_STATUS=  1.000000000000000
_SYSBLAS1=  1.000000000000000
_SYSBLAS2=  1.000000000000000
_SYSBLAS3=  1.000000000000000
_SYSTEM_RC=  1.000000000000000
_SYSTOT=  18.07000000000000
_T1DIAG=  18.07000000000000
_D1DIAG=  18.07000000000000
_TASK=  18.07000000000000
_TROV=  18.07000000000000
_HMAT=  18.07000000000000
_UMAT=  18.07000000000000
_UMATCI=  18.07000000000000
_VERSION=  2012001.000000000
_WALLBLAS1=  2012001.000000000
_WALLBLAS2=  2012001.000000000
_WALLBLAS3=  2012001.000000000
_WALLTOT=  441.7900000000000
_ZPE=  441.7900000000000
!DFBASIS_COUL=  441.7900000000000
!DFBASIS_EXCH=  441.7900000000000
!DFBASIS_MP2=  441.7900000000000
!DFBASIS_MC=  441.7900000000000
!DFBASIS_F12K=  441.7900000000000
!DFBASIS_CCSD=  441.7900000000000
!RIBASIS_MP2=  441.7900000000000
!RIBASIS_EXCH=  441.7900000000000
_DATE=15-May-15
_LASTORB=RHF
_MACHINE=Linux-2.6.18-371.11.1.el5.perfctr.2.6.42/node061(x86_64) 64 bit mpp version
_METHODC=
_METHODT=
_OUTPUT=/scratch/rrl581a/TestMolpro23830/molpro.xml
_PGROUP=C2v
_SEMI=
_TIME=16:28:35
_ANSATZ=
_LIBMOL=/g/software/lms/Molpro/molprop_2012_1_Linux_x86_64_i8/lib/
_VDIAG=
_UDIAG=
!AOINTADDSC=
_TRANSFORM_FORCE=
_SOLVE_ITER=
_VSCF_FREQ=
_VMCSCF_FREQ=
_VCI_FREQ=
_VMP2_FREQ=
_VSCF_INTENS=
_VMCSCF_INTENS=
_VCI_INTENS=
_VMP2_INTENS=
_VIB_PROG=
!EREF=
!VIBCNT=  0.000000000000000
!RGHFCNT=  0.000000000000000
!SURFREC=  0.000000000000000
!POLYREC=  0.000000000000000
!DIPREC=  0.000000000000000
!VSCFREC=  0.000000000000000
!VCIREC=  0.000000000000000
!PVCIREC=  0.000000000000000
!VMP2REC=  0.000000000000000
!VMCSCFREC=  0.000000000000000
!VMRCIREC=  0.000000000000000
!VIBINFO=  0.000000000000000
!GAREC=  0.000000000000000
!SCFORB=  21002.00000000000
!MCORB=  21002.00000000000
!CIOCC=  21002.00000000000
!CICORE=  21002.00000000000
!CICLOS=  21002.00000000000
!UNO_OCC=  21002.00000000000
!UNO_CLOSED=  21002.00000000000
!CINSTSYM=  21002.00000000000
!CIISTSYM=  21002.00000000000
!CIISTMS2=  21002.00000000000
!CIISTNEL=  21002.00000000000
!CIMS2=  21002.00000000000
!NEWMOL= -1.000000000000000
!NEWSYM= -1.000000000000000
!NEWORIENT= -1.000000000000000
_SLFILES=slscratch
_NGSSTO=  9.000000000000000
_SIN=SIN
_COS=COS
_TAN=TAN
_ACOS=ACOS
_ASIN=ASIN
_ATAN=ATAN
_COSH=COSH
_SINH=SINH
_TANH=TANH
_ABS=ABS
_MOD=MOD
_ERF=ERF
_REFC=REFC
_ERFC=ERFC
_HYPOT=HYPOT
_J0=J0
_J1=J1
_JN=JN
_GAMMA=GAMMA
_LGAMMA=LGAMMA
_Y0=Y0
_Y1=Y1
_YN=YN
_EXP=EXP
_LOG=LOG
_LOG10=LOG10
_SQRT=SQRT
_INT=INT
_NINT=NINT
_MAX=MAX
_MIN=MIN
_COSMO=  0.000000000000000
_COSMOIT=  0.000000000000000
_COSMOES=  0.000000000000000
_COSMOEDS=  0.000000000000000
_COSMOEC=  0.000000000000000
_COSMOEDCORR=  0.000000000000000
_FEPSI=  1.000000000000000
_SL_IsMM=  0.000000000000000
_SL_NSYM=  4.000000000000000
_SL_System_BitSw=  0.000000000000000
_SL_Unique_atoms=  0.000000000000000
_SL_Last_energy=  0.000000000000000
_SL_GRAD=  0.000000000000000
_SL_MAXUPD_Hess=  5.000000000000000
_SL_N_PRINT_COD=  5.000000000000000
_SL_PRINT_CODES=  0.000000000000000
_SL_BasType=  0.000000000000000
_SL_Energy_Pred=  0.000000000000000
_SL_New_Coords=  0.000000000000000
_SL_Total_Nuclea=  0.000000000000000
_SL_Highest_Mltp=  0.000000000000000
_SL_Ref_Geom=  0.000000000000000
_SL_Symmetry_ope=  1.000000000000000
_SL_agrad=  0.000000000000000
_SL_GrdMax=  0.000000000000000
_SL_GrdNorm=  0.000000000000000
_SL_GrdRMS=  0.000000000000000
_CONFIG=  0.000000000000000
_OCC=  0.000000000000000
_CORE=  0.000000000000000
_CLOSED=  0.000000000000000
_SCFOCC=  0.000000000000000
_SCFCLOSED=  0.000000000000000
_SCFCORE=  0.000000000000000
_MCOCC=  0.000000000000000
_MCCLOSED=  0.000000000000000
_MCFROZEN=  0.000000000000000
_MCCORE=  0.000000000000000
_CIOCC=  0.000000000000000
_CICLOSED=  0.000000000000000
_CICORE=  0.000000000000000
_CCOCC=  0.000000000000000
_CCCLOSED=  0.000000000000000
_CCCORE=  0.000000000000000
_SRXC=  0.000000000000000
_SRC=  0.000000000000000
_SRX=  0.000000000000000
_SRH=  0.000000000000000
_E_EXCHANGE=  0.000000000000000
!LATTICE= -1.000000000000000
!NEWLATTICE=  0.000000000000000
!LATGRAD_VAR=FALSE
!SEW_LATTICE=  1.000000000000000
_LATGRADX=  1.000000000000000
_LATGRADY=  1.000000000000000
_LATGRADZ=  1.000000000000000
!SCALTABINIT=  1.000000000000000
!LOCAL=  0.000000000000000
!SAVEOCC=  0.000000000000000
!SAVEDOM= -1.000000000000000
!RESTDOM= -1.000000000000000
!SAVEDOM_HF= -1.000000000000000
!RESTDOM_HF= -1.000000000000000
!HESSREC=  0.000000000000000
!FREQREC=  0.000000000000000
!NMODREC=  0.000000000000000
!GTASKS=  0.000000000000000
!HTASKS=  0.000000000000000
!THRCHG= 0.1000000000000000
!DEBUG= -1.000000000000000
!CFIT_CPHF=  0.000000000000000
!RDOMAUX_CPHF=  3.000000000000000
!THRAO_CPHF= 0.1000000000000000E-09
!THRMO_CPHF= 0.1000000000000000E-08
!THROV_CPHF= 0.1000000000000000E-11
!THRSW_CPHF= 0.1000000000000000E-09
!THRPROD_CPHF= 0.1000000000000000E-08
!THRAOPR_CPHF= 0.1000000000000000E-11
!CFIT_SCFGRD=  0.000000000000000
!RDOMAUX_SCFGRD=  5.000000000000000
!THRAO_SCFGRD= 0.1000000000000000E-09
!THRMO_SCFGRD= 0.1000000000000000E-08
!THROV_SCFGRD= 0.1000000000000000E-11
!THRSW_SCFGRD= 0.1000000000000000E-09
!THRPROD_SCFGRD= 0.1000000000000000E-08
!THRAOPR_SCFGRD= 0.1000000000000000E-11
!LOCFIT_SCF=  0.000000000000000
!LOCFIT_MP2= -1.000000000000000
_RIDOM=  0.000000000000000
_FCI_METHOD=  0.000000000000000
!CC2_METHOD=  0.000000000000000
_BASIS2006=FALSE
_SVDDEL= -1.000000000000000
_SVDDELA= -1.000000000000000
_SVDDELP= -1.000000000000000
_SVDDELF= -1.000000000000000
_SVDDELS= -1.000000000000000
_SVDDEL_ABS= -1.000000000000000
_SVDDELA_ABS= -1.000000000000000
_SVDDELP_ABS= -1.000000000000000
_SVDDELF_ABS= -1.000000000000000
_SVDDELS_ABS= -1.000000000000000
_MAXBASIS=  0.000000000000000
!OPT_CONICAL=  0.000000000000000
!CLEARSP_JGRID=  0.000000000000000
_SHLDTENSOR=  0.000000000000000
_SHLDTENSORDIA=  0.000000000000000
_SHLDTENSORPARA=  0.000000000000000
_OMEGAF_S=  0.000000000000000
_OMEGAF_T=  0.000000000000000
_DIPMOM_GS=  0.000000000000000
_DIPMOM_GS_REL=  0.000000000000000
_DIPMOM_SING=  0.000000000000000
_DIPMOM_SING_REL=  0.000000000000000
_DIPMOM_TRIP=  0.000000000000000
_DIPMOM_TRIP_REL=  0.000000000000000
_4EXT_NDISKS=  1.000000000000000
_RE=  1.000000000000000
_BE=  1.000000000000000
_AE=  1.000000000000000
_WE=  1.000000000000000
_WEXE=  1.000000000000000
_WEYE=  1.000000000000000
_METHOD=  1.000000000000000
_C0=  1.000000000000000
_C0R=  1.000000000000000
_REGRESSION_SLOPE=  1.000000000000000
_REGRESSION_INTERCEPT=  1.000000000000000
_LOWERBOUNDMIN_SLOPE=  1.000000000000000
_LOWERBOUNDMIN_INTERCEPT=  1.000000000000000
_UPPERBOUNDMIN_SLOPE=  1.000000000000000
_UPPERBOUNDMIN_INTERCEPT=  1.000000000000000
_LOWERBOUNDMAX_SLOPE=  1.000000000000000
_LOWERBOUNDMAX_INTERCEPT=  1.000000000000000
_UPPERBOUNDMAX_SLOPE=  1.000000000000000
_UPPERBOUNDMAX_INTERCEPT=  1.000000000000000
!ZMP=  0.000000000000000
_MAXIT_ZMP=  500.0000000000000
_MAXDIS_ZMP=  100.0000000000000
_ACCU_ZMP=  14.00000000000000
_SHIFTA_ZMP= -100.0000000000000
!EMBEDFLAG=  1.000000000000000
!EMBED=FALSE
!EMBED_F12=FALSE
!EMBEDNUC=  0.000000000000000
_EMBEDENERGY=  0.000000000000000
_KSPACETIME=  0.000000000000000
_RSPACETIME=  0.000000000000000
!EMBED_DFC=FALSE
!NUM_VOIDS=  0.000000000000000
_IBODY=  0.000000000000000
_EMBE_TOTAL=  0.000000000000000
_EMBE_HF=  0.000000000000000
_EMBE_CORR=  0.000000000000000
!EDFT=  0.000000000000000
_IFASTLATGRAD=  0.000000000000000
_SINDEX=  0.000000000000000
_F3SIZE=  0.000000000000000
_F4SIZE=  0.000000000000000
_AVDOM=  0.000000000000000
_AVDOMS=  0.000000000000000
!CPP_PROG=  0.000000000000000
_FCIQMC_ERR=  0.000000000000000
RCF=  1.340190000000000
RCC=  1.386195000000000
RCH=  1.078282000000000
ANG=  120.0000000000000
D0=  0.000000000000000
D180=  180.0000000000000
GX1=  2.619528914745834
GY1=  0.000000000000000
GZ1=-0.3986702745408743E-15
GX2=  5.152120978815622
GY2=-0.8654101858100688E-15
GZ2=-0.3986702745408743E-15
GX3=  1.309764457372916
GY3= -2.268578586117774
GZ3=-0.3986702745408743E-15
GX4=  2.328593293593639
GY4= -4.033241894668335
GZ4=-0.3986702745408743E-15
GX5= -1.309764457372919
GY5= -2.268578586117773
GZ5=-0.1208495241305383E-15
GX6= -2.576060489407813
GY6= -4.461867651025077
GZ6= 0.1477509191638239E-15
GX7= -2.619528914745835
GY7= 0.1790234627208065E-14
GZ7= 0.1569712262797975E-15
GX8= -4.657186587187280
GY8= 0.1129168464731742E-14
GZ8= 0.5891890807576425E-15
GX9= -1.309764457372915
GY9=  2.268578586117775
GZ9= 0.1569712262797966E-15
GX10= -2.576060489407808
GY10=  4.461867651025079
GZ10= 0.6941721128685211E-15
GX11=  1.309764457372920
GY11=  2.268578586117771
GZ11=-0.1208495241305406E-15
GX12=  2.328593293593645
GY12=  4.033241894668331
GZ12= 0.9525940310838112E-16
[Atoms] Angs
C     1    6         1.3861950000        0.0000000000        0.0000000000
F     2    9         2.7263850000        0.0000000000        0.0000000000
C     3    6         0.6930975000       -1.2004800846        0.0000000000
H     4    1         1.2322385000       -2.1342996890        0.0000000000
C     5    6        -0.6930975000       -1.2004800846        0.0000000000
F     6    9        -1.3631925000       -2.3611186705        0.0000000000
C     7    6        -1.3861950000        0.0000000000        0.0000000000
H     8    1        -2.4644770000        0.0000000000        0.0000000000
C     9    6        -0.6930975000        1.2004800846        0.0000000000
F    10    9        -1.3631925000        2.3611186705        0.0000000000
C    11    6         0.6930975000        1.2004800846        0.0000000000
H    12    1         1.2322385000        2.1342996890        0.0000000000
[GTO]
  1 0
 s   10  1.00
  0.8236000000D+04  0.5309998617D-03
  0.1235000000D+04  0.4107998930D-02
  0.2808000000D+03  0.2108699451D-01
  0.7927000000D+02  0.8185297868D-01
  0.2559000000D+02  0.2348169388D+00
  0.8997000000D+01  0.4344008869D+00
  0.3319000000D+01  0.3461289099D+00
  0.9059000000D+00  0.3937798974D-01
  0.3643000000D+00 -0.8982997660D-02
  0.1285000000D+00  0.2384999379D-02
 s   10  1.00
  0.8236000000D+04 -0.1129999414D-03
  0.1235000000D+04 -0.8779995449D-03
  0.2808000000D+03 -0.4539997647D-02
  0.7927000000D+02 -0.1813299060D-01
  0.2559000000D+02 -0.5575997110D-01
  0.8997000000D+01 -0.1268949342D+00
  0.3319000000D+01 -0.1703519117D+00
  0.9059000000D+00  0.1403819272D+00
  0.3643000000D+00  0.5986836897D+00
  0.1285000000D+00  0.3953887950D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.1000000000D+01
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.0000000000D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.0000000000D+00
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.1000000000D+01
 s    1  1.00
  0.4402000000D-01  0.1000000000D+01
 p    5  1.00
  0.1871000000D+02  0.1403099838D-01
  0.4133000000D+01  0.8686598995D-01
  0.1200000000D+01  0.2902159664D+00
  0.3827000000D+00  0.5010079421D+00
  0.1209000000D+00  0.3434059603D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.1000000000D+01
  0.1209000000D+00  0.0000000000D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.0000000000D+00
  0.1209000000D+00  0.1000000000D+01
 p    1  1.00
  0.3569000000D-01  0.1000000000D+01
 d    1  1.00
  0.1097000000D+01  0.1000000000D+01
 d    1  1.00
  0.3180000000D+00  0.1000000000D+01
 d    1  1.00
  0.1000000000D+00  0.1000000000D+01
 f    1  1.00
  0.7610000000D+00  0.1000000000D+01
 f    1  1.00
  0.2680000000D+00  0.1000000000D+01

  2 0
 s   10  1.00
  0.1950000000D+05  0.5070001688D-03
  0.2923000000D+04  0.3923001306D-02
  0.6645000000D+03  0.2020000673D-01
  0.1875000000D+03  0.7901002631D-01
  0.6062000000D+02  0.2304390767D+00
  0.2142000000D+02  0.4328721441D+00
  0.7950000000D+01  0.3499641165D+00
  0.2257000000D+01  0.4323301440D-01
  0.8815000000D+00 -0.7892002628D-02
  0.3041000000D+00  0.2384000794D-02
 s   10  1.00
  0.1950000000D+05 -0.1169999533D-03
  0.2923000000D+04 -0.9119996360D-03
  0.6645000000D+03 -0.4716998117D-02
  0.1875000000D+03 -0.1908599238D-01
  0.6062000000D+02 -0.5965497619D-01
  0.2142000000D+02 -0.1400099441D+00
  0.7950000000D+01 -0.1767819294D+00
  0.2257000000D+01  0.1716249315D+00
  0.8815000000D+00  0.6050427585D+00
  0.3041000000D+00  0.3695118525D+00
 s   10  1.00
  0.1950000000D+05  0.0000000000D+00
  0.2923000000D+04  0.0000000000D+00
  0.6645000000D+03  0.0000000000D+00
  0.1875000000D+03  0.0000000000D+00
  0.6062000000D+02  0.0000000000D+00
  0.2142000000D+02  0.0000000000D+00
  0.7950000000D+01  0.0000000000D+00
  0.2257000000D+01  0.1000000000D+01
  0.8815000000D+00  0.0000000000D+00
  0.3041000000D+00  0.0000000000D+00
 s   10  1.00
  0.1950000000D+05  0.0000000000D+00
  0.2923000000D+04  0.0000000000D+00
  0.6645000000D+03  0.0000000000D+00
  0.1875000000D+03  0.0000000000D+00
  0.6062000000D+02  0.0000000000D+00
  0.2142000000D+02  0.0000000000D+00
  0.7950000000D+01  0.0000000000D+00
  0.2257000000D+01  0.0000000000D+00
  0.8815000000D+00  0.0000000000D+00
  0.3041000000D+00  0.1000000000D+01
 s    1  1.00
  0.9158000000D-01  0.1000000000D+01
 p    5  1.00
  0.4388000000D+02  0.1666500251D-01
  0.9926000000D+01  0.1044720157D+00
  0.2930000000D+01  0.3172600478D+00
  0.9132000000D+00  0.4873430734D+00
  0.2672000000D+00  0.3346040504D+00
 p    5  1.00
  0.4388000000D+02  0.0000000000D+00
  0.9926000000D+01  0.0000000000D+00
  0.2930000000D+01  0.0000000000D+00
  0.9132000000D+00  0.1000000000D+01
  0.2672000000D+00  0.0000000000D+00
 p    5  1.00
  0.4388000000D+02  0.0000000000D+00
  0.9926000000D+01  0.0000000000D+00
  0.2930000000D+01  0.0000000000D+00
  0.9132000000D+00  0.0000000000D+00
  0.2672000000D+00  0.1000000000D+01
 p    1  1.00
  0.7361000000D-01  0.1000000000D+01
 d    1  1.00
  0.3107000000D+01  0.1000000000D+01
 d    1  1.00
  0.8550000000D+00  0.1000000000D+01
 d    1  1.00
  0.2920000000D+00  0.1000000000D+01
 f    1  1.00
  0.1917000000D+01  0.1000000000D+01
 f    1  1.00
  0.7240000000D+00  0.1000000000D+01

  3 0
 s   10  1.00
  0.8236000000D+04  0.5309998617D-03
  0.1235000000D+04  0.4107998930D-02
  0.2808000000D+03  0.2108699451D-01
  0.7927000000D+02  0.8185297868D-01
  0.2559000000D+02  0.2348169388D+00
  0.8997000000D+01  0.4344008869D+00
  0.3319000000D+01  0.3461289099D+00
  0.9059000000D+00  0.3937798974D-01
  0.3643000000D+00 -0.8982997660D-02
  0.1285000000D+00  0.2384999379D-02
 s   10  1.00
  0.8236000000D+04 -0.1129999414D-03
  0.1235000000D+04 -0.8779995449D-03
  0.2808000000D+03 -0.4539997647D-02
  0.7927000000D+02 -0.1813299060D-01
  0.2559000000D+02 -0.5575997110D-01
  0.8997000000D+01 -0.1268949342D+00
  0.3319000000D+01 -0.1703519117D+00
  0.9059000000D+00  0.1403819272D+00
  0.3643000000D+00  0.5986836897D+00
  0.1285000000D+00  0.3953887950D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.1000000000D+01
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.0000000000D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.0000000000D+00
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.1000000000D+01
 s    1  1.00
  0.4402000000D-01  0.1000000000D+01
 p    5  1.00
  0.1871000000D+02  0.1403099838D-01
  0.4133000000D+01  0.8686598995D-01
  0.1200000000D+01  0.2902159664D+00
  0.3827000000D+00  0.5010079421D+00
  0.1209000000D+00  0.3434059603D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.1000000000D+01
  0.1209000000D+00  0.0000000000D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.0000000000D+00
  0.1209000000D+00  0.1000000000D+01
 p    1  1.00
  0.3569000000D-01  0.1000000000D+01
 d    1  1.00
  0.1097000000D+01  0.1000000000D+01
 d    1  1.00
  0.3180000000D+00  0.1000000000D+01
 d    1  1.00
  0.1000000000D+00  0.1000000000D+01
 f    1  1.00
  0.7610000000D+00  0.1000000000D+01
 f    1  1.00
  0.2680000000D+00  0.1000000000D+01

 11 0
 s   10  1.00
  0.8236000000D+04  0.5309998617D-03
  0.1235000000D+04  0.4107998930D-02
  0.2808000000D+03  0.2108699451D-01
  0.7927000000D+02  0.8185297868D-01
  0.2559000000D+02  0.2348169388D+00
  0.8997000000D+01  0.4344008869D+00
  0.3319000000D+01  0.3461289099D+00
  0.9059000000D+00  0.3937798974D-01
  0.3643000000D+00 -0.8982997660D-02
  0.1285000000D+00  0.2384999379D-02
 s   10  1.00
  0.8236000000D+04 -0.1129999414D-03
  0.1235000000D+04 -0.8779995449D-03
  0.2808000000D+03 -0.4539997647D-02
  0.7927000000D+02 -0.1813299060D-01
  0.2559000000D+02 -0.5575997110D-01
  0.8997000000D+01 -0.1268949342D+00
  0.3319000000D+01 -0.1703519117D+00
  0.9059000000D+00  0.1403819272D+00
  0.3643000000D+00  0.5986836897D+00
  0.1285000000D+00  0.3953887950D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.1000000000D+01
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.0000000000D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.0000000000D+00
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.1000000000D+01
 s    1  1.00
  0.4402000000D-01  0.1000000000D+01
 p    5  1.00
  0.1871000000D+02  0.1403099838D-01
  0.4133000000D+01  0.8686598995D-01
  0.1200000000D+01  0.2902159664D+00
  0.3827000000D+00  0.5010079421D+00
  0.1209000000D+00  0.3434059603D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.1000000000D+01
  0.1209000000D+00  0.0000000000D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.0000000000D+00
  0.1209000000D+00  0.1000000000D+01
 p    1  1.00
  0.3569000000D-01  0.1000000000D+01
 d    1  1.00
  0.1097000000D+01  0.1000000000D+01
 d    1  1.00
  0.3180000000D+00  0.1000000000D+01
 d    1  1.00
  0.1000000000D+00  0.1000000000D+01
 f    1  1.00
  0.7610000000D+00  0.1000000000D+01
 f    1  1.00
  0.2680000000D+00  0.1000000000D+01

  4 0
 s    5  1.00
  0.3387000000D+02  0.6067999217D-02
  0.5095000000D+01  0.4530799416D-01
  0.1159000000D+01  0.2028219738D+00
  0.3258000000D+00  0.5039029350D+00
  0.1027000000D+00  0.3834209505D+00
 s    5  1.00
  0.3387000000D+02  0.0000000000D+00
  0.5095000000D+01  0.0000000000D+00
  0.1159000000D+01  0.0000000000D+00
  0.3258000000D+00  0.1000000000D+01
  0.1027000000D+00  0.0000000000D+00
 s    5  1.00
  0.3387000000D+02  0.0000000000D+00
  0.5095000000D+01  0.0000000000D+00
  0.1159000000D+01  0.0000000000D+00
  0.3258000000D+00  0.0000000000D+00
  0.1027000000D+00  0.1000000000D+01
 s    1  1.00
  0.2526000000D-01  0.1000000000D+01
 p    1  1.00
  0.1407000000D+01  0.1000000000D+01
 p    1  1.00
  0.3880000000D+00  0.1000000000D+01
 p    1  1.00
  0.1020000000D+00  0.1000000000D+01
 d    1  1.00
  0.1057000000D+01  0.1000000000D+01
 d    1  1.00
  0.2470000000D+00  0.1000000000D+01

 12 0
 s    5  1.00
  0.3387000000D+02  0.6067999217D-02
  0.5095000000D+01  0.4530799416D-01
  0.1159000000D+01  0.2028219738D+00
  0.3258000000D+00  0.5039029350D+00
  0.1027000000D+00  0.3834209505D+00
 s    5  1.00
  0.3387000000D+02  0.0000000000D+00
  0.5095000000D+01  0.0000000000D+00
  0.1159000000D+01  0.0000000000D+00
  0.3258000000D+00  0.1000000000D+01
  0.1027000000D+00  0.0000000000D+00
 s    5  1.00
  0.3387000000D+02  0.0000000000D+00
  0.5095000000D+01  0.0000000000D+00
  0.1159000000D+01  0.0000000000D+00
  0.3258000000D+00  0.0000000000D+00
  0.1027000000D+00  0.1000000000D+01
 s    1  1.00
  0.2526000000D-01  0.1000000000D+01
 p    1  1.00
  0.1407000000D+01  0.1000000000D+01
 p    1  1.00
  0.3880000000D+00  0.1000000000D+01
 p    1  1.00
  0.1020000000D+00  0.1000000000D+01
 d    1  1.00
  0.1057000000D+01  0.1000000000D+01
 d    1  1.00
  0.2470000000D+00  0.1000000000D+01

  5 0
 s   10  1.00
  0.8236000000D+04  0.5309998617D-03
  0.1235000000D+04  0.4107998930D-02
  0.2808000000D+03  0.2108699451D-01
  0.7927000000D+02  0.8185297868D-01
  0.2559000000D+02  0.2348169388D+00
  0.8997000000D+01  0.4344008869D+00
  0.3319000000D+01  0.3461289099D+00
  0.9059000000D+00  0.3937798974D-01
  0.3643000000D+00 -0.8982997660D-02
  0.1285000000D+00  0.2384999379D-02
 s   10  1.00
  0.8236000000D+04 -0.1129999414D-03
  0.1235000000D+04 -0.8779995449D-03
  0.2808000000D+03 -0.4539997647D-02
  0.7927000000D+02 -0.1813299060D-01
  0.2559000000D+02 -0.5575997110D-01
  0.8997000000D+01 -0.1268949342D+00
  0.3319000000D+01 -0.1703519117D+00
  0.9059000000D+00  0.1403819272D+00
  0.3643000000D+00  0.5986836897D+00
  0.1285000000D+00  0.3953887950D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.1000000000D+01
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.0000000000D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.0000000000D+00
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.1000000000D+01
 s    1  1.00
  0.4402000000D-01  0.1000000000D+01
 p    5  1.00
  0.1871000000D+02  0.1403099838D-01
  0.4133000000D+01  0.8686598995D-01
  0.1200000000D+01  0.2902159664D+00
  0.3827000000D+00  0.5010079421D+00
  0.1209000000D+00  0.3434059603D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.1000000000D+01
  0.1209000000D+00  0.0000000000D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.0000000000D+00
  0.1209000000D+00  0.1000000000D+01
 p    1  1.00
  0.3569000000D-01  0.1000000000D+01
 d    1  1.00
  0.1097000000D+01  0.1000000000D+01
 d    1  1.00
  0.3180000000D+00  0.1000000000D+01
 d    1  1.00
  0.1000000000D+00  0.1000000000D+01
 f    1  1.00
  0.7610000000D+00  0.1000000000D+01
 f    1  1.00
  0.2680000000D+00  0.1000000000D+01

  9 0
 s   10  1.00
  0.8236000000D+04  0.5309998617D-03
  0.1235000000D+04  0.4107998930D-02
  0.2808000000D+03  0.2108699451D-01
  0.7927000000D+02  0.8185297868D-01
  0.2559000000D+02  0.2348169388D+00
  0.8997000000D+01  0.4344008869D+00
  0.3319000000D+01  0.3461289099D+00
  0.9059000000D+00  0.3937798974D-01
  0.3643000000D+00 -0.8982997660D-02
  0.1285000000D+00  0.2384999379D-02
 s   10  1.00
  0.8236000000D+04 -0.1129999414D-03
  0.1235000000D+04 -0.8779995449D-03
  0.2808000000D+03 -0.4539997647D-02
  0.7927000000D+02 -0.1813299060D-01
  0.2559000000D+02 -0.5575997110D-01
  0.8997000000D+01 -0.1268949342D+00
  0.3319000000D+01 -0.1703519117D+00
  0.9059000000D+00  0.1403819272D+00
  0.3643000000D+00  0.5986836897D+00
  0.1285000000D+00  0.3953887950D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.1000000000D+01
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.0000000000D+00
 s   10  1.00
  0.8236000000D+04  0.0000000000D+00
  0.1235000000D+04  0.0000000000D+00
  0.2808000000D+03  0.0000000000D+00
  0.7927000000D+02  0.0000000000D+00
  0.2559000000D+02  0.0000000000D+00
  0.8997000000D+01  0.0000000000D+00
  0.3319000000D+01  0.0000000000D+00
  0.9059000000D+00  0.0000000000D+00
  0.3643000000D+00  0.0000000000D+00
  0.1285000000D+00  0.1000000000D+01
 s    1  1.00
  0.4402000000D-01  0.1000000000D+01
 p    5  1.00
  0.1871000000D+02  0.1403099838D-01
  0.4133000000D+01  0.8686598995D-01
  0.1200000000D+01  0.2902159664D+00
  0.3827000000D+00  0.5010079421D+00
  0.1209000000D+00  0.3434059603D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.1000000000D+01
  0.1209000000D+00  0.0000000000D+00
 p    5  1.00
  0.1871000000D+02  0.0000000000D+00
  0.4133000000D+01  0.0000000000D+00
  0.1200000000D+01  0.0000000000D+00
  0.3827000000D+00  0.0000000000D+00
  0.1209000000D+00  0.1000000000D+01
 p    1  1.00
  0.3569000000D-01  0.1000000000D+01
 d    1  1.00
  0.1097000000D+01  0.1000000000D+01
 d    1  1.00
  0.3180000000D+00  0.1000000000D+01
 d    1  1.00
  0.1000000000D+00  0.1000000000D+01
 f    1  1.00
  0.7610000000D+00  0.1000000000D+01
 f    1  1.00
  0.2680000000D+00  0.1000000000D+01

  6 0
 s   10  1.00
  0.1950000000D+05  0.5070001688D-03
  0.2923000000D+04  0.3923001306D-02
  0.6645000000D+03  0.2020000673D-01
  0.1875000000D+03  0.7901002631D-01
  0.6062000000D+02  0.2304390767D+00
  0.2142000000D+02  0.4328721441D+00
  0.7950000000D+01  0.3499641165D+00
  0.2257000000D+01  0.4323301440D-01
  0.8815000000D+00 -0.7892002628D-02
  0.3041000000D+00  0.2384000794D-02
 s   10  1.00
  0.1950000000D+05 -0.1169999533D-03
  0.2923000000D+04 -0.9119996360D-03
  0.6645000000D+03 -0.4716998117D-02
  0.1875000000D+03 -0.1908599238D-01
  0.6062000000D+02 -0.5965497619D-01
  0.2142000000D+02 -0.1400099441D+00
  0.7950000000D+01 -0.1767819294D+00
  0.2257000000D+01  0.1716249315D+00
  0.8815000000D+00  0.6050427585D+00
  0.3041000000D+00  0.3695118525D+00
 s   10  1.00
  0.1950000000D+05  0.0000000000D+00
  0.2923000000D+04  0.0000000000D+00
  0.6645000000D+03  0.0000000000D+00
  0.1875000000D+03  0.0000000000D+00
  0.6062000000D+02  0.0000000000D+00
  0.2142000000D+02  0.0000000000D+00
  0.7950000000D+01  0.0000000000D+00
  0.2257000000D+01  0.1000000000D+01
  0.8815000000D+00  0.0000000000D+00
  0.3041000000D+00  0.0000000000D+00
 s   10  1.00
  0.1950000000D+05  0.0000000000D+00
  0.2923000000D+04  0.0000000000D+00
  0.6645000000D+03  0.0000000000D+00
  0.1875000000D+03  0.0000000000D+00
  0.6062000000D+02  0.0000000000D+00
  0.2142000000D+02  0.0000000000D+00
  0.7950000000D+01  0.0000000000D+00
  0.2257000000D+01  0.0000000000D+00
  0.8815000000D+00  0.0000000000D+00
  0.3041000000D+00  0.1000000000D+01
 s    1  1.00
  0.9158000000D-01  0.1000000000D+01
 p    5  1.00
  0.4388000000D+02  0.1666500251D-01
  0.9926000000D+01  0.1044720157D+00
  0.2930000000D+01  0.3172600478D+00
  0.9132000000D+00  0.4873430734D+00
  0.2672000000D+00  0.3346040504D+00
 p    5  1.00
  0.4388000000D+02  0.0000000000D+00
  0.9926000000D+01  0.0000000000D+00
  0.2930000000D+01  0.0000000000D+00
  0.9132000000D+00  0.1000000000D+01
  0.2672000000D+00  0.0000000000D+00
 p    5  1.00
  0.4388000000D+02  0.0000000000D+00
  0.9926000000D+01  0.0000000000D+00
  0.2930000000D+01  0.0000000000D+00
  0.9132000000D+00  0.0000000000D+00
  0.2672000000D+00  0.1000000000D+01
 p    1  1.00
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 d    1  1.00
  0.3107000000D+01  0.1000000000D+01
 d    1  1.00
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 d    1  1.00
  0.2920000000D+00  0.1000000000D+01
 f    1  1.00
  0.1917000000D+01  0.1000000000D+01
 f    1  1.00
  0.7240000000D+00  0.1000000000D+01

 10 0
 s   10  1.00
  0.1950000000D+05  0.5070001688D-03
  0.2923000000D+04  0.3923001306D-02
  0.6645000000D+03  0.2020000673D-01
  0.1875000000D+03  0.7901002631D-01
  0.6062000000D+02  0.2304390767D+00
  0.2142000000D+02  0.4328721441D+00
  0.7950000000D+01  0.3499641165D+00
  0.2257000000D+01  0.4323301440D-01
  0.8815000000D+00 -0.7892002628D-02
  0.3041000000D+00  0.2384000794D-02
 s   10  1.00
  0.1950000000D+05 -0.1169999533D-03
  0.2923000000D+04 -0.9119996360D-03
  0.6645000000D+03 -0.4716998117D-02
  0.1875000000D+03 -0.1908599238D-01
  0.6062000000D+02 -0.5965497619D-01
  0.2142000000D+02 -0.1400099441D+00
  0.7950000000D+01 -0.1767819294D+00
  0.2257000000D+01  0.1716249315D+00
  0.8815000000D+00  0.6050427585D+00
  0.3041000000D+00  0.3695118525D+00
 s   10  1.00
  0.1950000000D+05  0.0000000000D+00
  0.2923000000D+04  0.0000000000D+00
  0.6645000000D+03  0.0000000000D+00
  0.1875000000D+03  0.0000000000D+00
  0.6062000000D+02  0.0000000000D+00
  0.2142000000D+02  0.0000000000D+00
  0.7950000000D+01  0.0000000000D+00
  0.2257000000D+01  0.1000000000D+01
  0.8815000000D+00  0.0000000000D+00
  0.3041000000D+00  0.0000000000D+00
 s   10  1.00
  0.1950000000D+05  0.0000000000D+00
  0.2923000000D+04  0.0000000000D+00
  0.6645000000D+03  0.0000000000D+00
  0.1875000000D+03  0.0000000000D+00
  0.6062000000D+02  0.0000000000D+00
  0.2142000000D+02  0.0000000000D+00
  0.7950000000D+01  0.0000000000D+00
  0.2257000000D+01  0.0000000000D+00
  0.8815000000D+00  0.0000000000D+00
  0.3041000000D+00  0.1000000000D+01
 s    1  1.00
  0.9158000000D-01  0.1000000000D+01
 p    5  1.00
  0.4388000000D+02  0.1666500251D-01
  0.9926000000D+01  0.1044720157D+00
  0.2930000000D+01  0.3172600478D+00
  0.9132000000D+00  0.4873430734D+00
  0.2672000000D+00  0.3346040504D+00
 p    5  1.00
  0.4388000000D+02  0.0000000000D+00
  0.9926000000D+01  0.0000000000D+00
  0.2930000000D+01  0.0000000000D+00
  0.9132000000D+00  0.1000000000D+01
  0.2672000000D+00  0.0000000000D+00
 p    5  1.00
  0.4388000000D+02  0.0000000000D+00
  0.9926000000D+01  0.0000000000D+00
  0.2930000000D+01  0.0000000000D+00
  0.9132000000D+00  0.0000000000D+00
  0.2672000000D+00  0.1000000000D+01
 p    1  1.00
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 d    1  1.00
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 d    1  1.00
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 d    1  1.00
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 f    1  1.00
  0.1917000000D+01  0.1000000000D+01
 f    1  1.00
  0.7240000000D+00  0.1000000000D+01

  7 0
 s   10  1.00
  0.8236000000D+04  0.5309998617D-03
  0.1235000000D+04  0.4107998930D-02
  0.2808000000D+03  0.2108699451D-01
  0.7927000000D+02  0.8185297868D-01
  0.2559000000D+02  0.2348169388D+00
  0.8997000000D+01  0.4344008869D+00
  0.3319000000D+01  0.3461289099D+00
  0.9059000000D+00  0.3937798974D-01
  0.3643000000D+00 -0.8982997660D-02
  0.1285000000D+00  0.2384999379D-02
 s   10  1.00
  0.8236000000D+04 -0.1129999414D-03
  0.1235000000D+04 -0.8779995449D-03
  0.2808000000D+03 -0.4539997647D-02
  0.7927000000D+02 -0.1813299060D-01
  0.2559000000D+02 -0.5575997110D-01
  0.8997000000D+01 -0.1268949342D+00
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[MO]
 Sym=      1.2
 Ene=     -26.3345
 Spin= Alpha
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 Ene=     -26.3345
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