Number of particles = 499
# (required) this must be the first line

A = 1.0 Angstrom (basic length-scale)
# (optional) basic length-scale: default A = 1.0 [Angstrom]

H0(1,1) = 18.0750003870952 A
H0(1,2) = 0 A
H0(1,3) = 0 A
# (required) this is the supercell's 1st edge, in A

H0(2,1) = 1.10677456843216e-15 A
H0(2,2) = 18.0750003870952 A
H0(2,3) = 0 A
# (required) this is the supercell's 2nd edge, in A

H0(3,1) = 1.10677456843216e-15 A
H0(3,2) = 1.10677456843216e-15 A
H0(3,3) = 18.0750003870952 A
# (required) this is the supercell's 3rd edge, in A

Transform(1,1) = 1
Transform(1,2) = 0
Transform(1,3) = 0
Transform(2,1) = 0
Transform(2,2) = 1
Transform(2,3) = 0
Transform(3,1) = 0
Transform(3,2) = 0
Transform(3,3) = 1
# (optional) apply additional transformation on H0:  H = H0 * Transform;
# default = Identity matrix.

eta(1,1) = 0
eta(1,2) = 0
eta(1,3) = 0
eta(2,2) = 0
eta(2,3) = 0
eta(3,3) = 0
# (optional) apply additional Lagrangian strain on H0:
# H = H0 * sqrt(Identity_matrix + 2 * eta);
# default = zero matrix.

# Each atom is described by a row:

# 1st entry is reduced coordinate s1 (dimensionless)
# 2nd entry is reduced coordinate s2 (dimensionless)
# 3rd entry is reduced coordinate s3 (dimensionless)
# real coordinates x = s * H,  x, s are 1x3 row vectors

.NO_VELOCITY.
# Atom velocities are deemed irrelevant for
# this configuration so they are not stored.

entry_count = 3

# These properties are piece-wise uniform:
63.546
# (required) atomic mass in a.m.u.
Cu
# (required) chemical symbol (max 2 chars)
.05 .148761164159411 .148761164159411
.148761164159411 .05 .148761164159411
.148761164159411 .148761164159411 .05
.0500000000000001 .05 .250455080031351
.05 .149994795198696 .350031647563587
.149994795198696 .05 .350031647563587
.149701754556016 .149701754556016 .249597409565354
.05 .05 .450012310022486
.05 .150001757403218 .55
.150001757403218 .05 .55
.149997795439639 .149997795439639 .450005579128328
.05 .05 .649987689977514
.0500000000000001 .149994795198696 .749968352436413
.149994795198696 .05 .749968352436413
.149997795439639 .149997795439639 .649994420871672
.05 .05 .849544919968649
.05 .148761164159411 .951238835840589
.148761164159411 .05 .951238835840589
.149701754556016 .149701754556016 .850402590434646
.05 .250455080031351 .05
.0500000000000001 .350031647563588 .149994795198696
.149701754556016 .249597409565354 .149701754556016
.149994795198696 .350031647563588 .05
.0500000000000001 .249421004760731 .249421004760731
.05 .349775130348564 .349775130348564
.149899438771706 .249833642931708 .349795929744177
.149899438771706 .349795929744177 .249833642931708
.05 .249978986293166 .449985092919041
.05 .349976765785902 .55
.149998543033962 .249994860897196 .55
.149966129189739 .349921475774666 .449910456189865
.05 .249978986293166 .650014907080959
.05 .349775130348564 .750224869651436
.149899438771706 .249833642931708 .750204070255823
.149966129189739 .349921475774666 .650089543810135
.05 .249421004760731 .850578995239269
.05 .350031647563587 .950005204801304
.149701754556016 .249597409565354 .950298245443984
.149899438771706 .349795929744177 .850166357068292
.0500000000000001 .450012310022486 .05
.05 .55 .150001757403218
.149997795439639 .450005579128328 .149997795439639
.150001757403218 .55 .05
.05 .449985092919041 .249978986293166
.05 .55 .349976765785902
.149966129189739 .449910456189865 .349921475774666
.149998543033962 .55 .249994860897196
.05 .449921417852602 .449921417852603
.05 .55 .55
.149973496550557 .449958634239678 .55
.149973496550557 .55 .449958634239678
.05 .449921417852602 .650078582147398
.05 .55 .750023234214098
.149966129189739 .449910456189865 .750078524225334
.149973496550557 .55 .650041365760322
.05 .449985092919042 .850021013706834
.05 .55 .949998242596782
.149997795439639 .450005579128328 .950002204560361
.149998543033962 .55 .850005139102804
.05 .649987689977514 .05
.05 .749968352436412 .149994795198696
.149997795439639 .649994420871672 .149997795439639
.149994795198696 .749968352436413 .05
.05 .650014907080958 .249978986293166
.05 .750224869651436 .349775130348564
.149966129189739 .650089543810135 .349921475774666
.149899438771706 .750204070255823 .249833642931708
.05 .650078582147398 .449921417852603
.0500000000000001 .750023234214098 .55
.149973496550557 .650041365760322 .55
.149966129189739 .750078524225334 .449910456189865
.05 .650078582147398 .650078582147398
.0499999999999999 .750224869651436 .750224869651436
.149966129189739 .650089543810135 .750078524225334
.149966129189739 .750078524225334 .650089543810135
.05 .650014907080959 .850021013706834
.05 .749968352436413 .950005204801304
.149997795439639 .649994420871672 .950002204560361
.149899438771706 .750204070255823 .850166357068292
.05 .849544919968649 .0500000000000001
.05 .951238835840589 .148761164159411
.149701754556016 .850402590434646 .149701754556016
.148761164159411 .951238835840589 .05
.05 .850578995239269 .249421004760731
.05 .950005204801304 .350031647563587
.149899438771706 .850166357068292 .349795929744177
.149701754556016 .950298245443984 .249597409565354
.05 .850021013706834 .449985092919041
.05 .949998242596782 .55
.149998543033962 .850005139102804 .55
.149997795439639 .950002204560361 .450005579128328
.0499999999999999 .850021013706834 .650014907080959
.0499999999999999 .950005204801304 .749968352436413
.149899438771706 .850166357068292 .750204070255823
.149997795439639 .950002204560361 .649994420871672
.0499999999999999 .850578995239269 .850578995239269
.05 .951238835840589 .951238835840589
.149701754556016 .850402590434646 .950298245443984
.149701754556016 .950298245443984 .850402590434646
.250455080031351 .05 .05
.249597409565354 .149701754556016 .149701754556016
.350031647563588 .05 .149994795198696
.350031647563587 .149994795198696 .05
.249421004760731 .05 .249421004760731
.249833642931708 .149899438771706 .349795929744177
.349775130348564 .05 .349775130348564
.349795929744177 .149899438771706 .249833642931708
.249978986293166 .05 .449985092919041
.249994860897196 .149998543033962 .55
.349976765785902 .05 .55
.349921475774666 .149966129189739 .449910456189865
.249978986293166 .05 .650014907080959
.249833642931708 .149899438771706 .750204070255823
.349775130348564 .05 .750224869651436
.349921475774666 .149966129189739 .650089543810135
.249421004760731 .05 .850578995239269
.249597409565354 .149701754556016 .950298245443984
.350031647563587 .05 .950005204801304
.349795929744177 .149899438771706 .850166357068292
.249421004760731 .249421004760731 .05
.249833642931708 .349795929744177 .149899438771706
.349795929744177 .249833642931708 .149899438771706
.349775130348564 .349775130348564 .05
.249775136358369 .249775136358369 .249775136358369
.249910298556708 .349878682724026 .349878682724026
.349878682724026 .249910298556708 .349878682724026
.349878682724026 .349878682724026 .249910298556708
.249941145787409 .249941145787409 .449909744086803
.249959142672915 .34995186598925 .55
.34995186598925 .249959142672915 .55
.349942523505622 .349942523505622 .449947355550233
.249941145787409 .249941145787409 .650090255913197
.249910298556708 .349878682724026 .750121317275974
.349878682724026 .249910298556708 .750121317275974
.349942523505622 .349942523505622 .650052644449767
.249775136358369 .249775136358369 .850224863641631
.249833642931708 .349795929744177 .950100561228294
.349795929744177 .249833642931708 .950100561228294
.349878682724026 .349878682724026 .850089701443292
.249978986293166 .449985092919042 .05
.249994860897196 .55 .149998543033962
.349921475774666 .449910456189865 .149966129189739
.349976765785902 .55 .05
.249941145787409 .449909744086803 .249941145787409
.249959142672915 .55 .34995186598925
.349942523505622 .449947355550233 .349942523505622
.34995186598925 .55 .249959142672915
.24995448869742 .449952614470496 .449952614470496
.249960349334481 .55 .55
.349958597349253 .449969222641566 .55
.349958597349253 .55 .449969222641566
.24995448869742 .449952614470496 .650047385529504
.249959142672915 .55 .75004813401075
.349942523505622 .449947355550233 .750057476494378
.349958597349253 .55 .650030777358434
.249941145787409 .449909744086803 .850058854212591
.249994860897196 .55 .950001456966038
.349921475774666 .449910456189865 .950033870810261
.34995186598925 .55 .850040857327085
.249978986293166 .650014907080959 .05
.249833642931708 .750204070255823 .149899438771706
.349921475774666 .650089543810135 .149966129189739
.349775130348564 .750224869651436 .05
.249941145787409 .650090255913197 .249941145787409
.249910298556708 .750121317275974 .349878682724026
.349942523505622 .650052644449767 .349942523505622
.349878682724026 .750121317275974 .249910298556708
.24995448869742 .650047385529504 .449952614470496
.249959142672915 .75004813401075 .55
.349958597349253 .650030777358434 .55
.349942523505622 .750057476494378 .449947355550233
.24995448869742 .650047385529505 .650047385529504
.249910298556708 .750121317275974 .750121317275974
.349942523505622 .650052644449767 .750057476494378
.349942523505622 .750057476494378 .650052644449767
.249941145787409 .650090255913197 .850058854212591
.249833642931708 .750204070255823 .950100561228294
.349921475774666 .650089543810135 .950033870810261
.349878682724026 .750121317275974 .850089701443292
.249421004760731 .850578995239269 .05
.249597409565354 .950298245443984 .149701754556016
.349795929744177 .850166357068292 .149899438771706
.350031647563587 .950005204801304 .05
.249775136358369 .850224863641631 .249775136358369
.249833642931708 .950100561228294 .349795929744177
.349878682724026 .850089701443292 .349878682724026
.349795929744177 .950100561228294 .249833642931708
.249941145787409 .850058854212591 .449909744086803
.249994860897196 .950001456966038 .55
.34995186598925 .850040857327085 .55
.349921475774666 .950033870810261 .449910456189865
.249941145787409 .850058854212591 .650090255913197
.249833642931708 .950100561228294 .750204070255823
.349878682724026 .850089701443292 .750121317275974
.349921475774666 .950033870810261 .650089543810135
.249775136358369 .850224863641631 .850224863641631
.249597409565354 .950298245443984 .950298245443984
.349795929744177 .850166357068292 .950100561228294
.349795929744177 .950100561228294 .850166357068292
.450012310022486 .05 .05
.450005579128328 .149997795439639 .149997795439639
.55 .05 .150001757403218
.55 .150001757403218 .05
.449985092919042 .05 .249978986293166
.449910456189865 .149966129189739 .349921475774666
.55 .05 .349976765785902
.55 .149998543033962 .249994860897196
.449921417852602 .05 .449921417852602
.449958634239678 .149973496550557 .55
.55 .05 .55
.55 .149973496550557 .449958634239678
.449921417852603 .05 .650078582147398
.449910456189865 .149966129189739 .750078524225334
.55 .05 .750023234214098
.55 .149973496550557 .650041365760322
.449985092919042 .05 .850021013706834
.450005579128328 .149997795439639 .950002204560361
.55 .05 .949998242596782
.55 .149998543033962 .850005139102804
.449985092919042 .249978986293166 .05
.449910456189865 .349921475774666 .149966129189739
.55 .249994860897196 .149998543033962
.55 .349976765785902 .05
.449909744086803 .249941145787409 .249941145787409
.449947355550233 .349942523505622 .349942523505622
.55 .249959142672915 .34995186598925
.55 .34995186598925 .249959142672915
.449952614470496 .24995448869742 .449952614470496
.449969222641566 .349958597349253 .55
.55 .249960349334481 .55
.55 .349958597349253 .449969222641566
.449952614470496 .24995448869742 .650047385529504
.449947355550233 .349942523505622 .750057476494378
.55 .249959142672915 .75004813401075
.55 .349958597349253 .650030777358434
.449909744086803 .249941145787409 .850058854212591
.449910456189865 .349921475774666 .950033870810261
.55 .249994860897196 .950001456966038
.55 .34995186598925 .850040857327085
.449921417852602 .449921417852602 .05
.449958634239678 .55 .149973496550557
.55 .449958634239678 .149973496550557
.55 .55 .05
.449952614470496 .449952614470496 .24995448869742
.449969222641566 .55 .349958597349253
.55 .449969222641566 .349958597349253
.55 .55 .249960349334481
.449970872280045 .449970872280045 .449970872280045
.449975767483636 .55 .55
.55 .449975767483636 .55
.55 .55 .449975767483636
.449970872280045 .449970872280045 .650029127719955
.449969222641566 .55 .750041402650747
.55 .449969222641566 .750041402650747
.55 .55 .650024232516364
.449952614470496 .449952614470496 .85004551130258
.449958634239678 .55 .950026503449443
.55 .449958634239678 .950026503449443
.55 .55 .850039650665519
.449921417852603 .650078582147398 .0500000000000001
.449910456189865 .750078524225334 .149966129189739
.55 .650041365760322 .149973496550557
.55 .750023234214098 .05
.449952614470496 .650047385529504 .24995448869742
.449947355550233 .750057476494378 .349942523505622
.55 .650030777358434 .349958597349253
.55 .75004813401075 .249959142672915
.449970872280045 .650029127719955 .449970872280045
.449969222641566 .750041402650747 .55
.55 .650024232516364 .55
.55 .750041402650747 .449969222641566
.449970872280045 .650029127719955 .650029127719955
.449947355550233 .750057476494378 .750057476494378
.55 .650030777358434 .750041402650747
.55 .750041402650747 .650030777358434
.449952614470496 .650047385529504 .85004551130258
.449910456189865 .750078524225334 .950033870810261
.55 .650041365760322 .950026503449443
.55 .75004813401075 .850040857327085
.449985092919042 .850021013706834 .05
.450005579128328 .950002204560361 .149997795439639
.55 .850005139102804 .149998543033962
.55 .949998242596782 .05
.449909744086803 .850058854212591 .249941145787409
.449910456189865 .950033870810261 .349921475774666
.55 .850040857327085 .34995186598925
.55 .950001456966038 .249994860897196
.449952614470496 .85004551130258 .449952614470496
.449958634239678 .950026503449443 .55
.55 .850039650665519 .55
.55 .950026503449443 .449958634239678
.449952614470496 .85004551130258 .650047385529504
.449910456189865 .950033870810261 .750078524225334
.55 .850040857327085 .75004813401075
.55 .950026503449443 .650041365760322
.449909744086803 .850058854212591 .850058854212591
.450005579128328 .950002204560361 .950002204560361
.55 .850005139102804 .950001456966038
.55 .950001456966038 .850005139102804
.649987689977514 .05 .05
.649994420871672 .149997795439639 .149997795439639
.749968352436413 .05 .149994795198696
.749968352436413 .149994795198696 .05
.650014907080959 .05 .249978986293166
.650089543810135 .149966129189739 .349921475774666
.750224869651436 .05 .349775130348564
.750204070255823 .149899438771706 .249833642931708
.650078582147398 .05 .449921417852602
.650041365760322 .149973496550557 .55
.750023234214098 .05 .55
.750078524225334 .149966129189739 .449910456189865
.650078582147398 .05 .650078582147397
.650089543810135 .149966129189739 .750078524225333
.750224869651436 .05 .750224869651436
.750078524225334 .149966129189739 .650089543810135
.650014907080959 .05 .850021013706834
.649994420871672 .149997795439639 .950002204560361
.749968352436413 .05 .950005204801304
.750204070255823 .149899438771706 .850166357068292
.650014907080959 .249978986293166 .0500000000000001
.650089543810135 .349921475774666 .149966129189739
.750204070255823 .249833642931708 .149899438771706
.750224869651436 .349775130348564 .05
.650090255913197 .249941145787409 .249941145787409
.650052644449767 .349942523505622 .349942523505622
.750121317275974 .249910298556708 .349878682724026
.750121317275974 .349878682724026 .249910298556708
.650047385529504 .24995448869742 .449952614470496
.650030777358434 .349958597349253 .55
.75004813401075 .249959142672915 .55
.750057476494378 .349942523505622 .449947355550233
.650047385529505 .24995448869742 .650047385529504
.650052644449767 .349942523505622 .750057476494378
.750121317275974 .249910298556708 .750121317275974
.750057476494378 .349942523505622 .650052644449767
.650090255913197 .249941145787409 .850058854212591
.650089543810135 .349921475774666 .950033870810261
.750204070255823 .249833642931708 .950100561228294
.750121317275974 .349878682724026 .850089701443292
.650078582147398 .449921417852602 .05
.650041365760322 .55 .149973496550557
.750078524225334 .449910456189865 .149966129189739
.750023234214098 .55 .0500000000000001
.650047385529504 .449952614470495 .24995448869742
.650030777358434 .55 .349958597349253
.750057476494378 .449947355550233 .349942523505622
.75004813401075 .55 .249959142672915
.650029127719955 .449970872280045 .449970872280045
.650024232516364 .55 .55
.750041402650747 .449969222641566 .55
.750041402650747 .55 .449969222641566
.650029127719955 .449970872280045 .650029127719955
.650030777358435 .55 .750041402650747
.750057476494378 .449947355550233 .750057476494378
.750041402650747 .55 .650030777358434
.650047385529504 .449952614470496 .85004551130258
.650041365760322 .55 .950026503449443
.750078524225334 .449910456189865 .950033870810261
.75004813401075 .55 .850040857327085
.650078582147398 .650078582147398 .05
.650089543810135 .750078524225334 .149966129189739
.750078524225334 .650089543810135 .149966129189739
.750224869651436 .750224869651436 .05
.650047385529504 .650047385529504 .24995448869742
.650052644449767 .750057476494378 .349942523505622
.750057476494378 .650052644449767 .349942523505622
.750121317275974 .750121317275974 .249910298556708
.650029127719955 .650029127719955 .449970872280045
.650030777358434 .750041402650747 .55
.750041402650747 .650030777358434 .55
.750057476494378 .750057476494378 .449947355550233
.650029127719955 .650029127719955 .650029127719955
.650052644449767 .750057476494378 .750057476494378
.750057476494378 .650052644449767 .750057476494378
.750057476494378 .750057476494378 .650052644449767
.650047385529504 .650047385529504 .85004551130258
.650089543810135 .750078524225334 .950033870810261
.750078524225334 .650089543810135 .950033870810261
.750121317275974 .750121317275974 .850089701443292
.650014907080959 .850021013706834 .05
.649994420871672 .950002204560361 .149997795439639
.750204070255823 .850166357068292 .149899438771706
.749968352436413 .950005204801304 .05
.650090255913197 .850058854212591 .249941145787409
.650089543810135 .950033870810261 .349921475774666
.750121317275974 .850089701443292 .349878682724026
.750204070255823 .950100561228294 .249833642931708
.650047385529504 .85004551130258 .449952614470495
.650041365760322 .950026503449443 .55
.75004813401075 .850040857327085 .55
.750078524225334 .950033870810261 .449910456189865
.650047385529505 .85004551130258 .650047385529504
.650089543810135 .950033870810261 .750078524225334
.750121317275974 .850089701443292 .750121317275974
.750078524225334 .950033870810261 .650089543810135
.650090255913197 .850058854212591 .850058854212591
.649994420871672 .950002204560361 .950002204560361
.750204070255823 .850166357068292 .950100561228294
.750204070255823 .950100561228294 .850166357068292
.849544919968649 .05 .05
.850402590434646 .149701754556016 .149701754556016
.951238835840589 .05 .148761164159411
.951238835840589 .148761164159411 .0500000000000001
.850578995239269 .05 .249421004760731
.850166357068292 .149899438771706 .349795929744177
.950005204801304 .05 .350031647563587
.950298245443984 .149701754556016 .249597409565354
.850021013706834 .05 .449985092919041
.850005139102804 .149998543033962 .55
.949998242596782 .05 .55
.950002204560361 .149997795439639 .450005579128328
.850021013706834 .05 .650014907080958
.850166357068292 .149899438771706 .750204070255823
.950005204801304 .05 .749968352436413
.950002204560361 .149997795439639 .649994420871672
.850578995239269 .05 .850578995239269
.850402590434646 .149701754556016 .950298245443984
.951238835840589 .05 .951238835840589
.950298245443984 .149701754556016 .850402590434646
.850578995239269 .249421004760731 .05
.850166357068292 .349795929744177 .149899438771706
.950298245443984 .249597409565354 .149701754556016
.950005204801304 .350031647563587 .05
.850224863641631 .249775136358369 .249775136358369
.850089701443292 .349878682724026 .349878682724026
.950100561228294 .249833642931708 .349795929744177
.950100561228294 .349795929744177 .249833642931708
.850058854212591 .249941145787409 .449909744086803
.850040857327085 .34995186598925 .55
.950001456966038 .249994860897196 .55
.950033870810261 .349921475774666 .449910456189865
.850058854212591 .249941145787409 .650090255913197
.850089701443292 .349878682724026 .750121317275974
.950100561228294 .249833642931708 .750204070255823
.950033870810261 .349921475774666 .650089543810135
.850224863641631 .249775136358369 .850224863641631
.850166357068292 .349795929744177 .950100561228294
.950298245443984 .249597409565354 .950298245443984
.950100561228294 .349795929744177 .850166357068292
.850021013706834 .449985092919042 .05
.850005139102804 .55 .149998543033962
.950002204560361 .450005579128328 .149997795439639
.949998242596782 .55 .05
.850058854212591 .449909744086803 .249941145787409
.850040857327085 .55 .34995186598925
.950033870810261 .449910456189865 .349921475774666
.950001456966038 .55 .249994860897196
.85004551130258 .449952614470495 .449952614470496
.850039650665519 .55 .55
.950026503449443 .449958634239678 .55
.950026503449443 .55 .449958634239678
.85004551130258 .449952614470496 .650047385529505
.850040857327085 .55 .75004813401075
.950033870810261 .449910456189865 .750078524225334
.950026503449443 .55 .650041365760322
.850058854212591 .449909744086803 .850058854212591
.850005139102804 .55 .950001456966038
.950002204560361 .450005579128328 .950002204560361
.950001456966038 .55 .850005139102804
.850021013706834 .650014907080959 .05
.850166357068292 .750204070255823 .149899438771706
.950002204560361 .649994420871672 .149997795439639
.950005204801304 .749968352436412 .05
.850058854212591 .650090255913197 .249941145787409
.850089701443292 .750121317275974 .349878682724026
.950033870810261 .650089543810135 .349921475774666
.950100561228294 .750204070255823 .249833642931708
.85004551130258 .650047385529504 .449952614470496
.850040857327085 .75004813401075 .55
.950026503449443 .650041365760322 .55
.950033870810261 .750078524225334 .449910456189865
.85004551130258 .650047385529504 .650047385529504
.850089701443292 .750121317275974 .750121317275974
.950033870810261 .650089543810135 .750078524225333
.950033870810261 .750078524225334 .650089543810135
.850058854212591 .650090255913197 .850058854212591
.850166357068292 .750204070255823 .950100561228294
.950002204560361 .649994420871672 .950002204560361
.950100561228294 .750204070255823 .850166357068292
.850578995239269 .850578995239269 .05
.850402590434646 .950298245443984 .149701754556016
.950298245443984 .850402590434646 .149701754556016
.951238835840589 .951238835840589 .05
.850224863641631 .850224863641631 .249775136358369
.850166357068292 .950100561228294 .349795929744177
.950100561228294 .850166357068292 .349795929744177
.950298245443984 .950298245443984 .249597409565354
.850058854212591 .850058854212591 .449909744086803
.850005139102804 .950001456966038 .55
.950001456966038 .850005139102804 .55
.950002204560361 .950002204560361 .450005579128328
.850058854212591 .850058854212591 .650090255913197
.850166357068292 .950100561228294 .750204070255823
.950100561228294 .850166357068292 .750204070255823
.950002204560361 .950002204560361 .649994420871672
.850224863641631 .850224863641631 .850224863641631
.850402590434646 .950298245443984 .950298245443984
.950298245443984 .850402590434646 .950298245443984
.950298245443984 .950298245443984 .850402590434646

# Analysis of this configuration:
# 
# supercell volume = 5905.20455127355 = 5905.20455127355 A^3
# avg. atomic volume = 11.8340772570612 = 11.8340772570612 A^3
# atomic number density = 0.0845017299006828 = 0.0845017299006828 A^-3
# avg. mass density = 8.91667273402962 g/cm^3
# 
# 499 mobile atoms,
# average velocity = ( 0  0  0 ),
# total kinetic energy = 0 = 0 [eV]
# avg. atomic kinetic energy = 0 = 0 [eV]
# = 0 [kJ/mol]
# MD temperature = 0 = 0 [K].
# 
# -------------- Species Summary --------------
# Type  Mass[amu]   Count  Abundance  Wt. Pct.
#  Cu     63.546      499   100.00%   100.00%
# ---------------------------------------------