aluminum,ref Al need abbrev Al(1) JA98 13.Aug.24 0.0 0.0 6.758 need vol 17.251065 -2.339753 2.806939 -240.216959 1800.00 argon,ref Ar need abbrev Ar(1) JA98 13.Aug.24 0.0 0.0 37.009 0.0 4.967973 0.000000 0.000000 0.000000 1800.00 boron,ref B need abbrev B(1) JA98 13.Aug.24 0.0 0.0 1.394 0.0 9.019346 0.059245 -0.696951 -96.024642 1800.00 barium,ref Ba need abbrev Ba(1) JA98 13.Aug.24 0.0 0.0 14.932 0.0 6.853288 -0.149329 -6.211724 117.042555 1800.00 beryllium,ref Be need abbrev Be(1) JA98 13.Aug.24 0.0 0.0 2.256 0.0 13.920459 -1.166265 1.664283 -198.208481 1800.00 bromine,ref Br2 need abbrev Br(2) JA98 13.Aug.24 0.0 0.0 36.378 0.0 51.869350 -9.580181 30.898438 -1143.136194 1800.00 carbon,ref C need abbrev C(1) JA98 13.Aug.24 0.0 0.0 1.372 0.0 11.924491 -0.923428 1.129289 -188.163992 1800.00 calcium,ref Ca need abbrev Ca(1) JA98 13.Aug.24 0.0 0.0 9.940 0.0 50.764910 -11.838463 14.625062 -989.534647 1800.00 chlorine,ref Cl2 need abbrev Cl(2) JA98 13.Aug.24 0.0 0.0 53.317 0.0 9.329195 0.058742 -0.458261 -12.461824 1800.00 cobalt,ref Co need abbrev Co(1) JA98 13.Aug.24 0.0 0.0 7.186 0.0 47.898898 -8.512362 16.146041 -988.742958 1800.00 chromium,ref Cr need abbrev Cr(1) JA98 13.Aug.24 0.0 0.0 5.645 0.0 -6.670157 6.842045 -3.737545 248.432279 1800.00 cesium,ref Cs need abbrev Cs(1) JA98 13.Aug.24 0.0 0.0 20.351 0.0 -5.243940 1.326237 -5.880791 329.834872 1800.00 copper,ref Cu need abbrev Cu(1) JA98 13.Aug.24 0.0 0.0 7.926 0.0 9.061819 0.572469 1.444956 -85.851757 1800.00 deuterium,ref D2 need abbrev D(2) JA98 13.Aug.24 0.0 0.0 34.646 0.0 6.791117 1.094134 0.495876 -11.708108 1800.00 electron gas,ref e- need abbrev e(1)- JA98 13.Aug.24 0.0 0.0 5.014 0.0 4.967973 0.000000 0.000000 0.000000 1800.00 fluorine,ref F2 need abbrev F(2) JA98 13.Aug.24 0.0 0.0 48.468 0.0 10.683425 -0.089562 -0.009462 -54.804105 1800.00 iron,ref Fe need abbrev Fe(1) JA98 13.Aug.24 0.0 0.0 6.530 0.0 73.936424 -17.654064 20.306589 -1475.397808 1800.00 gallium,ref Ga need abbrev Ga(1) JA98 13.Aug.24 0.0 0.0 9.761 0.0 5.120722 0.300847 -0.548062 30.794780 1800.00 hydrogen,ref H2 need abbrev H(2) JA98 13.Aug.24 0.0 0.0 31.233 0.0 4.011598 1.517724 -0.723508 56.038411 1800.00 helium,ref He need abbrev He(1) JA98 13.Aug.24 0.0 0.0 30.151 0.0 4.967973 0.000000 0.000000 0.000000 1800.00 hafnium,ref Hf need abbrev Hf(1) JA98 13.Aug.24 0.0 0.0 10.411 0.0 6.884251 1.539185 0.246957 -25.516506 1800.00 mercury,ref Hg need abbrev Hg(1) JA98 13.Aug.24 0.0 0.0 18.171 0.0 -7.680860 3.050351 -4.348845 316.872651 1800.00 iodine,ref I2 need abbrev I(2) JA98 13.Aug.24 0.0 0.0 27.759 0.0 -57.572152 17.659170 -22.992971 1596.646116 1800.00 potassium,ref K need abbrev K(1) JA98 13.Aug.24 0.0 0.0 15.457 0.0 -1.911164 0.308551 -5.507357 262.243635 1800.00 krypton,ref Kr need abbrev Kr(1) JA98 13.Aug.24 0.0 0.0 39.217 0.0 4.967973 0.000000 0.000000 0.000000 1800.00 lithium,ref Li need abbrev Li(1) JA98 13.Aug.24 0.0 0.0 6.951 0.0 14.621043 -3.314538 0.050837 -133.635685 1800.00 magnesium,ref Mg need abbrev Mg(1) JA98 13.Aug.24 0.0 0.0 7.809 0.0 42.901605 -11.454486 10.500982 -781.631059 1800.00 manganese,ref Mn need abbrev Mn(1) JA98 13.Aug.24 0.0 0.0 7.651 0.0 6.456804 2.980860 -0.214718 -14.049486 1800.00 molybdenum,ref Mo need abbrev Mo(1) JA98 13.Aug.24 0.0 0.0 6.837 0.0 1.661734 2.488997 -1.594282 87.955630 1800.00 nitrogen,ref N2 need abbrev N(2) JA98 13.Aug.24 0.0 0.0 45.796 0.0 9.804247 0.273477 1.333387 -75.985807 1800.00 sodium,ref Na need abbrev Na(1) JA98 13.Aug.24 0.0 0.0 12.298 0.0 2.776949 -0.947279 -4.221482 155.574271 1800.00 niobium,ref Nb need abbrev Nb(1) JA98 13.Aug.24 0.0 0.0 8.715 0.0 4.432135 1.368794 -0.578752 29.470706 1800.00 neon,ref Ne need abbrev Ne(1) JA98 13.Aug.24 0.0 0.0 34.973 0.0 4.967973 0.000000 0.000000 0.000000 1800.00 nickel,ref Ni need abbrev Ni(1) JA98 13.Aug.24 0.0 0.0 7.139 0.0 -9.545626 5.197958 -9.040733 417.503558 1800.00 oxygen,ref O2 need abbrev O(2) JA98 13.Aug.24 0.0 0.0 49.031 0.0 11.833565 -0.256568 1.295832 -106.915934 1800.00 phosphorus,ref P need abbrev P(1) JA98 13.Aug.24 0.0 0.0 9.818 0.0 6.080610 -1.753481 -2.520101 52.014163 1800.00 lead,ref Pb need abbrev Pb(1) JA98 13.Aug.24 0.0 0.0 15.484 0.0 6.734584 -0.175091 -1.262746 19.040206 1800.00 rubidium,ref Rb need abbrev Rb(1) JA98 13.Aug.24 0.0 0.0 18.350 0.0 -6.248418 1.535593 -6.666407 357.297177 1800.00 radon,ref Rn need abbrev Rn(1) JA98 13.Aug.24 0.0 0.0 42.121 0.0 4.967973 0.000000 0.000000 0.000000 1800.00 sulfur,ref S need abbrev S(1) JA98 13.Aug.24 0.0 0.0 7.662 0.0 -42.807682 10.083700 -27.060985 1288.085228 1800.00 silicon,ref Si need abbrev Si(1) JA98 13.Aug.24 0.0 0.0 4.498 0.0 9.646641 -0.428869 0.560353 -92.320165 1800.00 strontium,ref Sr need abbrev Sr(1) JA98 13.Aug.24 0.0 0.0 13.311 0.0 45.588805 -10.156016 14.160203 -894.361014 1800.00 tantalum,ref Ta need abbrev Ta(1) JA98 13.Aug.24 0.0 0.0 9.912 0.0 6.793301 0.426116 0.067537 -16.445230 1800.00 titanium,ref Ti need abbrev Ti(1) JA98 13.Aug.24 0.0 0.0 7.352 0.0 6.486477 0.962003 -0.669828 -0.046719 1800.00 vanadium,ref V need abbrev V(1) JA98 13.Aug.24 0.0 0.0 6.916 0.0 0.376933 3.391180 -1.818966 113.994982 1800.00 tungsten,ref W need abbrev W(1) JA98 13.Aug.24 0.0 0.0 7.806 0.0 5.046914 1.207522 -0.219408 11.192457 1800.00 xenon,ref Xe need abbrev Xe(1) JA98 13.Aug.24 0.0 0.0 40.555 0.0 4.967973 0.000000 0.000000 0.000000 1800.00 zinc,ref Zn need abbrev Zn(1) JA98 13.Aug.24 0.0 0.0 9.971 0.0 17.531957 -4.981648 0.533931 -184.701349 1800.00 zirconium,ref Zr need abbrev Zr(1) JA98 13.Aug.24 0.0 0.0 9.290 0.0 10.510207 -0.494855 1.025572 -95.055240 1800.00