$ ../crystal.exe

     ######################################################################
   ##########################################################################
  ###                                                                      ###
 ###            TINKER  ---  Software Tools for Molecular Design            ###
 ##                                                                          ##
 ##                        Version 8.4  February 2018                        ##
 ##                                                                          ##
 ##               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                                                    ###
  ###                                                                      ###
   ##########################################################################
     ######################################################################


 Enter Cartesian Coordinate File Name :  a.xyz

 The Tinker Crystal Structure Utility Can :

    (1) Convert Fractional to Cartesian Coords
    (2) Convert Cartesian to Fractional Coords
    (3) Move Any Stray Molecules into Unit Cell
    (4) Make a Unit Cell from Asymmetric Unit
    (5) Make a Big Block from Single Unit Cell

 Enter the Number of the Desired Choice :  1

 Enter Unit Cell Axis Lengths :  1 1 1

 Enter Unit Cell Axis Angles :   90 90 90

 Unit Cell Dimensions :      a    =    1.0000
                             b    =    1.0000
                             c    =    1.0000
                            Alpha =   90.0000
                            Beta  =   90.0000
                            Gamma =   90.0000

HP@LAPTOP-CLDEEOLQ /home/tinker/bin/test
$ ../crystal.exe

     ######################################################################
   ##########################################################################
  ###                                                                      ###
 ###            TINKER  ---  Software Tools for Molecular Design            ###
 ##                                                                          ##
 ##                        Version 8.4  February 2018                        ##
 ##                                                                          ##
 ##               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                                                    ###
  ###                                                                      ###
   ##########################################################################
     ######################################################################


 Enter Cartesian Coordinate File Name :  a.xyz

 The Tinker Crystal Structure Utility Can :

    (1) Convert Fractional to Cartesian Coords
    (2) Convert Cartesian to Fractional Coords
    (3) Move Any Stray Molecules into Unit Cell
    (4) Make a Unit Cell from Asymmetric Unit
    (5) Make a Big Block from Single Unit Cell

 Enter the Number of the Desired Choice :  2

 Enter Unit Cell Axis Lengths :  1 1 1

 Enter Unit Cell Axis Angles :   90 90 90

 Unit Cell Dimensions :      a    =    1.0000
                             b    =    1.0000
                             c    =    1.0000
                            Alpha =   90.0000
                            Beta  =   90.0000
                            Gamma =   90.0000

HP@LAPTOP-CLDEEOLQ /home/tinker/bin/test
$ ../crystal.exe

     ######################################################################
   ##########################################################################
  ###                                                                      ###
 ###            TINKER  ---  Software Tools for Molecular Design            ###
 ##                                                                          ##
 ##                        Version 8.4  February 2018                        ##
 ##                                                                          ##
 ##               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                                                    ###
  ###                                                                      ###
   ##########################################################################
     ######################################################################


 Enter Cartesian Coordinate File Name :  a.xyz

 The Tinker Crystal Structure Utility Can :

    (1) Convert Fractional to Cartesian Coords
    (2) Convert Cartesian to Fractional Coords
    (3) Move Any Stray Molecules into Unit Cell
    (4) Make a Unit Cell from Asymmetric Unit
    (5) Make a Big Block from Single Unit Cell

 Enter the Number of the Desired Choice :  3

 Enter Unit Cell Axis Lengths :  1 1 1

 Enter Unit Cell Axis Angles :   90 90 90

 Unit Cell Dimensions :      a    =    1.0000
                             b    =    1.0000
                             c    =    1.0000
                            Alpha =   90.0000
                            Beta  =   90.0000
                            Gamma =   90.0000

HP@LAPTOP-CLDEEOLQ /home/tinker/bin/test
$ ../crystal.exe

     ######################################################################
   ##########################################################################
  ###                                                                      ###
 ###            TINKER  ---  Software Tools for Molecular Design            ###
 ##                                                                          ##
 ##                        Version 8.4  February 2018                        ##
 ##                                                                          ##
 ##               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                                                    ###
  ###                                                                      ###
   ##########################################################################
     ######################################################################


 Enter Cartesian Coordinate File Name :  a.xyz

 The Tinker Crystal Structure Utility Can :

    (1) Convert Fractional to Cartesian Coords
    (2) Convert Cartesian to Fractional Coords
    (3) Move Any Stray Molecules into Unit Cell
    (4) Make a Unit Cell from Asymmetric Unit
    (5) Make a Big Block from Single Unit Cell

 Enter the Number of the Desired Choice :  4

 Available Crystallographic Space Groups :

   (1) P1           (2) P2           (3) P1(-)        (4) P21
   (5) C2           (6) Pm           (7) Pc           (8) Cm
   (9) Cc          (10) P2/m        (11) P21/m       (12) C2/m
  (13) P2/c        (14) P21/c       (15) P21/n       (16) P21/a
  (17) C2/c        (18) P21212      (19) P212121     (20) C2221
  (21) Pca21       (22) Pmn21       (23) Pna21       (24) Pn21a
  (25) Cmc21       (26) Aba2        (27) Fdd2        (28) Pnna
  (29) Pmna        (30) Pcca        (31) Pbam        (32) Pccn
  (33) Pbcm        (34) Pnnm        (35) Pbcn        (36) Pbca
  (37) Pnma        (38) Cmcm        (39) Cmca        (40) P41
  (41) P43         (42) I4(-)       (43) P42/n       (44) I41/a
  (45) P41212      (46) P43212      (47) P4(-)21m    (48) P4(-)21c
  (49) P4(-)m2     (50) R3(-)       (51) R3c         (52) P63/m
  (53) P6(3)/mmc   (54) Pa3(-)      (55) P43m        (56) I4(-)3m
  (57) P4(-)3n     (58) Pm3(-)m     (59) Fm3(-)m     (60) Im3(-)m

 Enter the Number of the Desired Choice :  4

 Enter Unit Cell Axis Lengths :  1 1 1

 Enter Unit Cell Axis Angles :   90 90 90

 Unit Cell Dimensions :      a    =    1.0000
                             b    =    1.0000
                             c    =    1.0000
                            Alpha =   90.0000
                            Beta  =   90.0000
                            Gamma =   90.0000

 Space Group Symbol :            P21

 Attempt to Merge Fragments to Form Full Molecules [N] :   N

 Move Any Stray Molecules into Unit Cell [N] :   N

 Locate Center of Unit Cell at Coordinate Origin [N] :   N

HP@LAPTOP-CLDEEOLQ /home/tinker/bin/test
$ ../crystal.exe

     ######################################################################
   ##########################################################################
  ###                                                                      ###
 ###            TINKER  ---  Software Tools for Molecular Design            ###
 ##                                                                          ##
 ##                        Version 8.4  February 2018                        ##
 ##                                                                          ##
 ##               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                                                    ###
  ###                                                                      ###
   ##########################################################################
     ######################################################################


 Enter Cartesian Coordinate File Name :  a.xyz

 The Tinker Crystal Structure Utility Can :

    (1) Convert Fractional to Cartesian Coords
    (2) Convert Cartesian to Fractional Coords
    (3) Move Any Stray Molecules into Unit Cell
    (4) Make a Unit Cell from Asymmetric Unit
    (5) Make a Big Block from Single Unit Cell

 Enter the Number of the Desired Choice :  5

 Enter Unit Cell Axis Lengths :  1 1 1

 Enter Unit Cell Axis Angles :   90 90 90

 Unit Cell Dimensions :      a    =    1.0000
                             b    =    1.0000
                             c    =    1.0000
                            Alpha =   90.0000
                            Beta  =   90.0000
                            Gamma =   90.0000

 Enter Number of Replicates along a-, b- and c-Axes [1 1 1] :   1 1 1

 Dimensions of the  1 x  1 x  1 Cell Block :

 New Cell Dimensions :       a    =    1.0000
                             b    =    1.0000
                             c    =    1.0000