
                    DL_POLY Version 2.20

                              Running on   32 nodes


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 ***************     DL_POLY BENCHMARK 1  : 19652 AL ATOMS                                                ***************
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 ************************************************************************************************************************


 SIMULATION CONTROL PARAMETERS


 simulation temperature           3.0000E+02

 selected number of timesteps         1000

 simulation timestep              5.0000E-03

 real space cut off               8.6000E+00

 border width of Verlet shell     1.0000E+00

 Evans Gaussian temperature constraints in use


 electrostatic potential terms off

 data printing interval                100

 statistics file interval              100

 user allocated job time (h)      1.0000

 job closure time        (s)     100.000


SYSTEM SPECIFICATION

 energy units=kjoule/mol 


 number of molecular types               1

 molecular species type                  1


 name of species:             Aluminium                               

 number of molecules                 19652

 number of atoms/sites                   1


 atomic characteristics:

                      site     name          mass        charge    repeat    freeze

                         1     Al          26.98150     0.00000         1         0


 number of specified metal potentials         1


                atom 1  atom 2      key                              parameters


                Al      Al        stch     3.31470E-02  4.05000E+00  7.00000E+00  6.00000E+00  1.63990E+01

 configuration file name: 

          DL_POLY BENCHMARK 1: 19652 ATOM AL SYSTEM                                       


 selected image convention               1


 simulation cell vectors


                        91.885000    0.000000    0.000000
                         0.000000   91.885000    0.000000
                         0.000000    0.000000   91.885000


 system volume            775771.568579    


 link cell algorithm in use


 total degrees of freedom                     58953.
 rotational degrees of freedom                    0.
 shell pseudo degrees of freedom                  0.


 sample of starting configuration

      i       x(i)        y(i)        z(i)       vx(i)       vy(i)       vz(i)


      1 -4.5942E+01 -4.5942E+01 -4.3240E+01  6.1653E+00 -1.3245E+00 -3.1778E+00
    984 -4.0538E+01 -1.6215E+01 -2.7025E+00  1.2137E+00 -1.7396E+00  9.3823E-01
   1967 -3.5133E+01 -2.9727E+01  3.7835E+01 -1.8306E+00  1.7108E-01  3.8619E-01
   2950 -3.2430E+01 -4.3240E+01 -1.6215E+01  1.9965E-01  1.5423E+00 -4.7014E+00
   3933 -3.2430E+01  3.5133E+01  2.9727E+01 -1.1207E+00  1.5572E+00  1.9955E+00
   4916 -2.4323E+01  2.1620E+01 -1.8918E+01  5.7756E+00 -9.4355E-01 -1.7195E-01
   5899 -1.8918E+01  8.1075E+00  2.1620E+01  2.1393E+00 -4.7916E+00 -3.9969E+00
   6882 -1.6215E+01 -5.4050E+00 -3.2430E+01  3.8390E+00  3.5151E+00 -5.1830E+00
   7865 -1.0810E+01 -1.8918E+01  1.3512E+01 -3.0754E+00 -1.9741E+00 -2.4367E+00
   8848 -2.7025E+00 -3.2430E+01 -3.5133E+01 -2.1332E+00 -1.6222E+00  7.5310E-01
   9831  0.0000E+00 -4.5942E+01 -3.5133E+01 -1.8953E+00 -3.6820E+00 -1.1322E+00
  10814  0.0000E+00  3.5133E+01 -4.5942E+01  7.0354E-01 -1.2197E+00  3.5733E+00
  11797  5.4050E+00  1.8918E+01 -2.7025E+00 -2.8925E+00  9.4578E-01  4.4614E+00
  12780  1.3512E+01  0.0000E+00  4.0538E+01 -5.4894E-01  1.7241E+00 -4.2317E+00
  13763  1.8918E+01 -8.1075E+00 -1.0810E+01 -3.1669E+00  3.9076E+00 -1.1369E+00
  14746  2.1620E+01 -2.7025E+01  2.7025E+01  1.6326E+00  2.7413E+00 -3.2949E+00
  15729  2.7025E+01 -3.5133E+01 -1.8918E+01  2.5111E+00 -2.1249E+00 -4.1739E+00
  16712  2.9727E+01  3.7835E+01  2.4323E+01 -2.0933E+00  8.0583E-02 -6.7919E-01
  17695  3.5133E+01  2.9727E+01 -2.7025E+01  3.6756E+00 -8.4959E-01  1.5824E-01
  18678  3.7835E+01  1.0810E+01  1.0810E+01 -7.1364E+00  2.9255E+00  5.9530E+00


long range correction for: vdw energy     0.000000E+00
                         : vdw pressure  -0.000000E+00


long range corrections for metal potentials

short range energy and virial corrections:   8.469058E+01  -5.928341E+02

density dependent energy and virial corrections

                         Al         2.175302E+01   6.525905E+01

 time elapsed since job start =          46.294 seconds

 ------------------------------------------------------------------------------------------------------------------------

     step     eng_tot    temp_tot     eng_cfg     eng_vdw     eng_cou     eng_bnd     eng_ang     eng_dih     eng_tet
 time          eng_pv    temp_rot     vir_cfg     vir_vdw     vir_cou     vir_bnd     vir_ang     vir_con     vir_tet
 cpu time      volume    temp_shl     eng_shl     vir_shl       alpha        beta       gamma     vir_pmf       press

 ------------------------------------------------------------------------------------------------------------------------
        1  3.1604E+04  3.0000E+02 -4.1920E+04 -4.1920E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   5.000f  4.7430E+04  0.0000E+00  9.9574E+04  9.9574E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
  46.342s  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  3.3431E-01

  rolling  3.1604E+04  3.0000E+02 -4.1920E+04 -4.1920E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  4.7430E+04  0.0000E+00  9.9574E+04  9.9574E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  3.3431E-01
 ------------------------------------------------------------------------------------------------------------------------
      100  2.6103E+04  2.9995E+02 -4.7410E+04 -4.7410E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 500.000f  8.8948E+04  0.0000E+00 -4.1505E+04 -4.1505E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
  49.898s  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.3276E+00

  rolling  2.8428E+04  2.9996E+02 -4.5087E+04 -4.5087E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  7.4025E+04  0.0000E+00  1.0238E+04  1.0238E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  9.6325E-01
 ------------------------------------------------------------------------------------------------------------------------
      200  2.5941E+04  2.9995E+02 -4.7572E+04 -4.7572E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.000p  8.6312E+04  0.0000E+00 -3.4085E+04 -3.4085E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
  53.520s  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2753E+00

  rolling  2.6019E+04  2.9995E+02 -4.7494E+04 -4.7494E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  8.7256E+04  0.0000E+00 -3.6686E+04 -3.6686E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2936E+00
 ------------------------------------------------------------------------------------------------------------------------
      300  2.5776E+04  2.9995E+02 -4.7738E+04 -4.7738E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.500p  8.6107E+04  0.0000E+00 -3.3968E+04 -3.3968E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
  57.134s  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2745E+00

  rolling  2.5915E+04  2.9995E+02 -4.7598E+04 -4.7598E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  8.6226E+04  0.0000E+00 -3.3906E+04 -3.3906E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2741E+00
 ------------------------------------------------------------------------------------------------------------------------
      400  2.5980E+04  2.9995E+02 -4.7532E+04 -4.7532E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   2.000p  8.7114E+04  0.0000E+00 -3.6378E+04 -3.6378E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.013m  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2915E+00

  rolling  2.5865E+04  2.9995E+02 -4.7648E+04 -4.7648E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  8.6529E+04  0.0000E+00 -3.4966E+04 -3.4966E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2815E+00
 ------------------------------------------------------------------------------------------------------------------------
      500  2.6048E+04  2.9995E+02 -4.7465E+04 -4.7465E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   2.500p  8.7189E+04  0.0000E+00 -3.6398E+04 -3.6398E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.074m  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2916E+00

  rolling  2.5973E+04  2.9995E+02 -4.7539E+04 -4.7539E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  8.6689E+04  0.0000E+00 -3.5123E+04 -3.5123E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2826E+00
 ------------------------------------------------------------------------------------------------------------------------
      600  2.5870E+04  2.9995E+02 -4.7643E+04 -4.7643E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   3.000p  8.6535E+04  0.0000E+00 -3.4970E+04 -3.4970E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.135m  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2816E+00

  rolling  2.6013E+04  2.9995E+02 -4.7499E+04 -4.7499E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  8.7131E+04  0.0000E+00 -3.6327E+04 -3.6327E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2911E+00
 ------------------------------------------------------------------------------------------------------------------------
      700  2.5907E+04  2.9995E+02 -4.7606E+04 -4.7606E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   3.500p  8.6599E+04  0.0000E+00 -3.5051E+04 -3.5051E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.196m  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2821E+00

  rolling  2.5805E+04  2.9995E+02 -4.7708E+04 -4.7708E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  8.5948E+04  0.0000E+00 -3.3403E+04 -3.3403E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2705E+00
 ------------------------------------------------------------------------------------------------------------------------
 ------------------------------------------------------------------------------------------------------------------------

     step     eng_tot    temp_tot     eng_cfg     eng_vdw     eng_cou     eng_bnd     eng_ang     eng_dih     eng_tet
 time          eng_pv    temp_rot     vir_cfg     vir_vdw     vir_cou     vir_bnd     vir_ang     vir_con     vir_tet
 cpu time      volume    temp_shl     eng_shl     vir_shl       alpha        beta       gamma     vir_pmf       press

 ------------------------------------------------------------------------------------------------------------------------
      800  2.6035E+04  2.9995E+02 -4.7478E+04 -4.7478E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   4.000p  8.7203E+04  0.0000E+00 -3.6480E+04 -3.6480E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.257m  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2922E+00

  rolling  2.5880E+04  2.9995E+02 -4.7633E+04 -4.7633E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  8.6449E+04  0.0000E+00 -3.4681E+04 -3.4681E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2795E+00
 ------------------------------------------------------------------------------------------------------------------------
      900  2.5912E+04  2.9995E+02 -4.7601E+04 -4.7601E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   4.500p  8.6940E+04  0.0000E+00 -3.6057E+04 -3.6057E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.318m  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2892E+00

  rolling  2.5888E+04  2.9995E+02 -4.7625E+04 -4.7625E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  8.6645E+04  0.0000E+00 -3.5247E+04 -3.5247E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2835E+00
 ------------------------------------------------------------------------------------------------------------------------
     1000  2.5836E+04  2.9995E+02 -4.7677E+04 -4.7677E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   5.000p  8.6662E+04  0.0000E+00 -3.5450E+04 -3.5450E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.379m  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2849E+00

  rolling  2.5815E+04  2.9995E+02 -4.7698E+04 -4.7698E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 averages  8.6377E+04  0.0000E+00 -3.4660E+04 -3.4660E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2794E+00
 ------------------------------------------------------------------------------------------------------------------------


 run terminating. elapsed cpu time =   8.27410E+01, job time =   1.000h, close time =  100.00s



 run terminated after    1000 steps. final averages calculated over    1000 steps.


 ------------------------------------------------------------------------------------------------------------------------

     step     eng_tot    temp_tot     eng_cfg     eng_vdw     eng_cou     eng_bnd     eng_ang     eng_dih     eng_tet
 time          eng_pv    temp_rot     vir_cfg     vir_vdw     vir_cou     vir_bnd     vir_ang     vir_con     vir_tet
 cpu time      volume    temp_shl     eng_shl     vir_shl       alpha        beta       gamma     vir_pmf       press

 ------------------------------------------------------------------------------------------------------------------------
     1000  2.6160E+04  2.9995E+02 -4.7353E+04 -4.7353E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   5.000p  8.5328E+04  0.0000E+00 -3.0476E+04 -3.0476E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
   1.387m  7.7577E+05  0.0000E+00  0.0000E+00  0.0000E+00  9.0000E+01  9.0000E+01  9.0000E+01  0.0000E+00  1.2499E+00

  r.m.s.   9.1222E+02  9.9469E-03  9.1130E+02  9.1130E+02  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
 fluctn.   7.7867E+03  0.0000E+00  2.5195E+04  2.5195E+04  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00  0.0000E+00
           4.9131E-10  0.0000E+00  0.0000E+00  0.0000E+00  3.1634E-14  3.1634E-14  3.1634E-14  0.0000E+00  1.7739E-01
 ------------------------------------------------------------------------------------------------------------------------


            Approximate 3D Diffusion  coefficients (10^-9 m^2 / s)

            atom        D 
            Al         6.2559E+01


                Average pressure tensor                                       r.m.s. fluctuations 

           1.2478E+00  5.1503E-05  2.8410E-03                          1.7845E-01  1.0779E-02  8.4474E-03
           5.1503E-05  1.2505E+00 -4.4050E-03                          1.0779E-02  1.7639E-01  8.7621E-03
           2.8410E-03 -4.4050E-03  1.2515E+00                          8.4474E-03  8.7621E-03  1.7807E-01

            trace/3.   1.2499E+00


 sample of final configuration

      i       x(i)        y(i)        z(i)       vx(i)       vy(i)       vz(i)       fx(i)       fy(i)       fz(i)


      1 -3.8018E+01 -3.2487E+01  4.2780E+01 -5.6799E-01  1.3086E+00 -1.1389E+00 -2.6392E+02  1.4455E+02 -1.1215E+02
    984 -2.3589E+01 -1.6541E+01 -2.2198E+00 -4.9789E-01  2.0974E+00  1.9787E+00 -8.8634E+02  4.1919E+01 -1.8232E+02
   1967  3.6628E+01 -2.6733E+01 -4.0924E+01 -7.6594E+00  1.9371E+00  2.4007E+00 -9.1418E+01  5.3803E+01 -3.3619E+01
   2950 -3.3635E+01  4.2768E+01 -2.1303E+01  3.5130E+00 -2.3687E+00  3.1014E+00 -3.2967E+01 -3.2462E+00  5.4874E+00
   3933 -3.4710E+01  3.4693E+01  2.3783E+01 -4.0041E-01 -1.2529E+00  4.3540E-01 -8.6359E+01  2.3031E+02 -1.0805E+01
   4916 -2.2662E+01  1.8063E+01 -1.0692E+01 -3.5872E+00 -1.6540E+00 -3.6727E-01 -6.2144E+01 -2.6661E-01  3.3503E+01
   5899 -2.6957E+00 -1.8505E+01  1.4818E+01 -1.4639E+00 -1.0487E+00 -6.5188E-01 -7.8253E+02 -1.1240E+02 -8.5449E+02
   6882 -1.2369E+01 -9.7321E+00 -2.2161E+01 -1.0943E+00 -4.3805E+00  3.5960E+00 -2.6253E+01 -6.4014E+00  5.7937E+01
   7865 -9.6724E+00 -1.3929E+01 -1.8954E+00  2.6321E+00 -1.8615E+00 -3.4385E+00  8.6370E+01 -8.4066E+00  4.0864E+01
   8848  3.5445E+00 -3.4053E+01 -3.8590E+01  1.9432E+00  1.2087E+00 -1.4252E+00 -1.1243E+03 -4.0292E+02  1.5152E+03
   9831 -1.3073E+01  3.4097E+01 -3.2879E+01 -1.5211E+00 -1.1615E+00 -6.7131E+00  6.5565E+01 -1.9209E+01  2.5005E+01
  10814 -6.2271E+00  3.3583E+01 -4.5146E+01 -3.7430E+00 -2.0092E+00  2.6030E+00  3.4092E+01 -4.9486E+01  2.5205E+01
  11797 -6.7906E+00  2.6752E+01  1.5861E+01 -3.4098E+00  2.6881E+00  5.9892E+00 -2.1251E+02 -2.0067E+03  8.7260E+02
  12780  9.8058E+00  3.5732E+00  3.5604E+01 -3.6398E+00 -6.4224E-01 -1.7905E+00  2.0639E+01  9.6418E+01 -7.1049E+01
  13763  1.5437E+01 -7.3880E+00 -2.1478E+01 -6.7412E-01 -2.5951E+00  2.8696E+00  2.7042E+01  6.3397E+00 -3.6790E+01
  14746  2.8382E+01 -2.1714E+01  3.1637E+01  2.1440E+00  2.2135E+00  9.9927E-01 -4.6074E+01 -9.5865E+01  5.8627E+01
  15729  2.3693E+01 -4.1342E+01 -2.0054E+01 -1.1416E+00 -1.0329E-01  1.6159E+00  2.5678E+01 -1.5835E+01  3.2033E+01
  16712  3.2654E+01  4.2425E+01  2.4020E+01 -5.7615E+00  3.5733E-02 -1.1948E+00  3.5821E+00  2.9285E+01 -2.9179E+01
  17695  3.1737E+01  3.7256E+01 -2.8682E+01 -3.3587E+00  6.5631E+00 -3.4558E+00  2.6277E+01 -3.1139E+01  2.2392E+01
  18678  2.4320E+01  1.8114E+01  1.0971E+01 -1.1800E+00 -1.5801E-01 -1.3871E+00  5.4080E+01  7.0239E+01 -4.8652E+01

 time elapsed since job start =          83.198 seconds

