Hg1 W47 S96 1.0 19.144551 0.000000 0.000000 0.000000 22.106223 0.000000 0.000000 0.000000 14.200541 Hg W S 1 47 96 direct -0.001954 0.750368 0.499999 Hg 0.089129 0.877763 0.500001 W -0.000061 0.496619 0.500000 W 0.084293 0.620246 0.500000 W 0.171069 0.751422 0.500000 W 0.252679 0.876680 0.500000 W 0.000043 0.249096 0.500001 W 0.083597 0.373310 0.500001 W 0.167457 0.497845 0.500000 W 0.250211 0.624762 0.500000 W 0.335129 0.750377 0.500000 W 0.417491 0.875762 0.500000 W 0.000140 0.000034 0.500000 W 0.083605 0.124805 0.500000 W 0.166976 0.249429 0.500001 W 0.250435 0.374171 0.500001 W 0.333463 0.499804 0.500001 W 0.416834 0.625040 0.500001 W 0.499924 0.750250 0.500001 W 0.582528 0.875805 0.500001 W 0.168423 0.001733 0.500000 W 0.250816 0.125733 0.500001 W 0.333738 0.250175 0.500001 W 0.416793 0.375143 0.500001 W 0.500037 0.500064 0.500001 W 0.583351 0.625075 0.500000 W 0.664710 0.750288 0.500000 W 0.747169 0.876721 0.500000 W 0.334516 0.001068 0.500002 W 0.417034 0.125725 0.500001 W 0.500013 0.250478 0.500001 W 0.583234 0.375151 0.500001 W 0.666674 0.499831 0.500000 W 0.750195 0.624851 0.500000 W 0.828505 0.752666 0.500001 W 0.911402 0.877823 0.500000 W 0.500050 0.000884 0.500001 W 0.583039 0.125711 0.500001 W 0.666280 0.250100 0.500001 W 0.749499 0.374032 0.500001 W 0.832488 0.497582 0.500000 W 0.917039 0.618983 0.499999 W 0.665619 0.001092 0.500001 W 0.749325 0.125699 0.500002 W 0.833070 0.249390 0.500001 W 0.916485 0.373244 0.500001 W 0.831919 0.001723 0.500001 W 0.916515 0.124808 0.500001 W 0.094093 0.797880 0.385291 S 0.170477 0.919686 0.388455 S 0.084229 0.537714 0.388986 S 0.166221 0.666747 0.390623 S 0.253515 0.792807 0.389070 S 0.335128 0.917923 0.388794 S 0.083494 0.290436 0.389038 S 0.167097 0.415000 0.389039 S 0.250188 0.541286 0.389241 S 0.333554 0.666596 0.389221 S 0.417521 0.792229 0.388958 S 0.500013 0.917593 0.388951 S 0.083549 0.041713 0.389155 S 0.166947 0.166449 0.389112 S 0.250279 0.291169 0.389088 S 0.333452 0.416535 0.389217 S 0.416733 0.541671 0.389290 S 0.500067 0.666715 0.389233 S 0.582316 0.792228 0.389010 S 0.664876 0.918018 0.388727 S 0.251388 0.042933 0.388972 S 0.333893 0.167233 0.388989 S 0.416822 0.292019 0.389117 S 0.500010 0.416855 0.389193 S 0.583373 0.541690 0.389326 S 0.666781 0.666533 0.389235 S 0.745878 0.793041 0.388956 S 0.829844 0.919542 0.388770 S 0.417262 0.042647 0.388928 S 0.500030 0.167385 0.389056 S 0.583205 0.292006 0.389128 S 0.666566 0.416533 0.389213 S 0.749990 0.541376 0.389266 S 0.834756 0.667214 0.391391 S 0.903649 0.798508 0.382948 S 0.000040 0.915536 0.391330 S 0.582853 0.042647 0.388935 S 0.666190 0.167162 0.388992 S 0.749704 0.291058 0.389067 S 0.832842 0.414749 0.389050 S 0.915697 0.536897 0.388560 S -0.000435 0.654797 0.385334 S 0.748854 0.042874 0.389011 S 0.833158 0.166423 0.389099 S 0.916569 0.290392 0.389037 S 0.000065 0.414110 0.388865 S 0.916748 0.041694 0.389138 S 0.000052 0.166086 0.389185 S 0.094093 0.797880 0.614709 S 0.170477 0.919686 0.611544 S 0.084230 0.537714 0.611012 S 0.166220 0.666747 0.609377 S 0.253515 0.792807 0.610931 S 0.335128 0.917923 0.611206 S 0.083494 0.290436 0.610961 S 0.167097 0.415000 0.610960 S 0.250188 0.541286 0.610758 S 0.333555 0.666595 0.610778 S 0.417520 0.792230 0.611041 S 0.500013 0.917593 0.611048 S 0.083549 0.041713 0.610844 S 0.166947 0.166449 0.610887 S 0.250279 0.291169 0.610912 S 0.333452 0.416535 0.610781 S 0.416733 0.541671 0.610709 S 0.500068 0.666714 0.610766 S 0.582316 0.792228 0.610990 S 0.664877 0.918018 0.611272 S 0.251387 0.042934 0.611028 S 0.333893 0.167233 0.611010 S 0.416822 0.292019 0.610882 S 0.500010 0.416855 0.610806 S 0.583373 0.541691 0.610673 S 0.666781 0.666533 0.610764 S 0.745878 0.793041 0.611043 S 0.829844 0.919542 0.611228 S 0.417262 0.042647 0.611074 S 0.500030 0.167385 0.610941 S 0.583205 0.292005 0.610871 S 0.666566 0.416533 0.610787 S 0.749990 0.541376 0.610734 S 0.834756 0.667214 0.608608 S 0.903649 0.798508 0.617052 S 0.000040 0.915537 0.608669 S 0.582854 0.042647 0.611065 S 0.666190 0.167162 0.611007 S 0.749704 0.291058 0.610932 S 0.832842 0.414749 0.610951 S 0.915697 0.536898 0.611439 S -0.000435 0.654797 0.614665 S 0.748854 0.042874 0.610989 S 0.833159 0.166423 0.610901 S 0.916569 0.290392 0.610963 S 0.000065 0.414111 0.611135 S 0.916748 0.041694 0.610861 S 0.000053 0.166086 0.610814 S