$ ../testpol.exe

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  ###                                                                      ###
 ###            TINKER  ---  Software Tools for Molecular Design            ###
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 ##                        Version 8.4  February 2018                        ##
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 ##               Copyright (c)  Jay William Ponder  1990-2018               ##
 ###                           All Rights Reserved                          ###
  ###                                                                      ###
  ### Special version for Windows (x86)                                    ###
  ### compiled by Alan Liska & Veronika Ruzickova                          ###
  ### on March 21, 2019                                                    ###
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 Enter Cartesian Coordinate File Name :  a.xyz

 Additional Atomic Multipoles for Specific Atoms :

      Atom         Coordinate Frame Definition        Multipole Moments

         1          2      3      4   3-Fold     -0.22011
                                                  0.00000  0.00000  0.29395
                                                  0.35844
                                                  0.00000  0.35844
                                                  0.00000  0.00000 -0.71688

         2          1      3      4   Z-Bisect    0.07337
                                                 -0.01503  0.00000 -0.16505
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         3          1      2      4   Z-Bisect    0.07337
                                                 -0.01503  0.00000 -0.16505
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         4          1      2      3   Z-Bisect    0.07337
                                                 -0.01503  0.00000 -0.16505
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         5          6      7      8   3-Fold     -0.22011
                                                  0.00000  0.00000  0.29395
                                                  0.35844
                                                  0.00000  0.35844
                                                  0.00000  0.00000 -0.71688

         6          5      7      8   Z-Bisect    0.07337
                                                 -0.01503  0.00000 -0.16505
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         7          5      6      8   Z-Bisect    0.07337
                                                 -0.01503  0.00000 -0.16505
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         8          5      6      7   Z-Bisect    0.07337
                                                 -0.01503  0.00000 -0.16505
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         1          2      3      4   3-Fold     -0.22011
                                                  0.00075  0.00130  0.25195
                                                  0.35844
                                                  0.00000  0.35844
                                                  0.00000  0.00000 -0.71688

         2          1      3      4   Z-Bisect    0.07337
                                                 -0.01475 -0.00127 -0.16197
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         3          1      2      4   Z-Bisect    0.07337
                                                 -0.01475  0.00126 -0.16197
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         4          1      2      3   Z-Bisect    0.07337
                                                 -0.01033  0.00000 -0.15554
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         5          6      7      8   3-Fold     -0.22011
                                                 -0.03087  0.00000  0.27461
                                                  0.35844
                                                  0.00000  0.35844
                                                  0.00000  0.00000 -0.71688

         6          5      7      8   Z-Bisect    0.07337
                                                 -0.01913  0.00657 -0.18447
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         7          5      6      8   Z-Bisect    0.07337
                                                 -0.00773  0.00000 -0.08459
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

         8          5      6      7   Z-Bisect    0.07337
                                                 -0.01913 -0.00657 -0.18447
                                                 -0.05100
                                                  0.00000  0.04892
                                                  0.02991  0.00000  0.00208

 Direct Induced Dipole Moments :

    Atom               X             Y             Z            Norm

       1          0.052302      0.000000      0.028265      0.059451
       2          0.011455      0.003979      0.005504      0.013317
       3          0.011456     -0.003978      0.005500      0.013316
       4          0.001522     -0.000001      0.019480      0.019539
       5          0.124030      0.000002     -0.020717      0.125749
       6          0.035539      0.012982      0.001866      0.037882
       7          0.181992      0.000003     -0.015069      0.182615
       8          0.035540     -0.012982      0.001866      0.037883

 Iterative PCG Induced Dipole Moments :    (  6 Iterations)

    Atom               X             Y             Z            Norm

       1          0.103548     -0.000001      0.026262      0.106826
       2          0.002451      0.008122     -0.000473      0.008497
       3          0.002452     -0.008118     -0.000478      0.008494
       4         -0.007680     -0.000004      0.025836      0.026953
       5          0.088266      0.000001     -0.028000      0.092600
       6          0.035757      0.034680      0.018512      0.053141
       7          0.205070      0.000003     -0.010489      0.205338
       8          0.035757     -0.034679      0.018513      0.053141

 Exact SCF Induced Dipole Moments :

    Atom              X             Y             Z            Norm

       1          0.103548     -0.000001      0.026262      0.106826
       2          0.002451      0.008122     -0.000473      0.008497
       3          0.002452     -0.008118     -0.000478      0.008494
       4         -0.007680     -0.000004      0.025836      0.026953
       5          0.088266      0.000001     -0.028000      0.092600
       6          0.035757      0.034680      0.018512      0.053141
       7          0.205070      0.000003     -0.010489      0.205338
       8          0.035757     -0.034679      0.018513      0.053141

 Extrapolated OPT4 Induced Dipole Moments :

    Atom               X             Y             Z            Norm

       1          0.103615     -0.000001      0.026270      0.106894
       2          0.002121      0.008146     -0.000446      0.008430
       3          0.002122     -0.008143     -0.000452      0.008427
       4         -0.007799     -0.000004      0.025616      0.026777
       5          0.088078      0.000001     -0.028138      0.092464
       6          0.035870      0.034592      0.018629      0.053201
       7          0.204418      0.000003     -0.010680      0.204696
       8          0.035870     -0.034592      0.018629      0.053201

 Approximate vs. Exact Induced Dipoles :

    Atom              Direct              PCG              OPT4

       1          0.0512854000      0.0000000080      0.0000676221
       2          0.0115739860      0.0000000050      0.0003317644
       3          0.0115742835      0.0000000050      0.0003317662
       4          0.0111836193      0.0000000049      0.0002504599
       5          0.0364985826      0.0000000034      0.0002329157
       6          0.0273484978      0.0000000018      0.0001847598
       7          0.0235277719      0.0000000015      0.0006795752
       8          0.0273485158      0.0000000018      0.0001847551

     RMS          0.0282948118      0.0000000045      0.0003301102

 Iterative PCG Induced Dipole Convergence :

    Iter            RMS Change           RMS vs Exact

       0               ----              0.0282948118
       1          0.0256672871           0.0028028213
       2          0.0027369352           0.0001110832
       3          0.0001100532           0.0000107390
       4          0.0000096497           0.0000018472
       5          0.0000018397           0.0000000304
       6          0.0000000296           0.0000000045
       7          0.0000000040           0.0000000009
       8          0.0000000009           0.0000000000

 Extrapolated OPT4 Coefficient Refinement :

    Iter        C0        C1        C2        C3        C4      RMS vs Exact

       0     -0.041    -0.176     0.169     0.663     0.374     0.0003301102
     100     -0.036    -0.149     0.162     0.665     0.352     0.0001621153
     200     -0.031    -0.153     0.140     0.681     0.357     0.0001546746
     300     -0.006    -0.103    -0.079     0.524     0.661     0.0000721076
     371      0.001    -0.089    -0.133     0.481     0.737     0.0000632980