No title
    1.0
            11.08690000 0.00000000 0.00000000 
            5.54345000 9.60153705 0.00000000 
            0.00000000 0.00000000 29.05240000 
  Pt H O S
  64 4 4 1
Direct
        0.66357446 0.67196251 0.00279033      	#	1      	Pt1
        0.41366208 0.92186194 0.00275376      	#	2      	Pt2
        0.41372443 0.67186319 0.00285108      	#	3      	Pt3
        0.16366799 0.92189847 0.00276133      	#	4      	Pt4
        0.91397755 0.42159002 0.00272559      	#	5      	Pt5
        0.91377566 0.17187753 0.00273454      	#	6      	Pt6
        0.66360663 0.42184438 0.00276196      	#	7      	Pt7
        0.16342913 0.17211439 0.00259996      	#	8      	Pt8
        0.91356444 0.92198189 0.00276362      	#	9      	Pt9
        0.91363135 0.67186192 0.00286114      	#	10     	Pt10
        0.66368051 0.92187035 0.00278611      	#	11     	Pt11
        0.16359252 0.67201740 0.00281885      	#	12     	Pt12
        0.66378188 0.17184639 0.00274615      	#	13     	Pt13
        0.41382240 0.42181367 0.00286334      	#	14     	Pt14
        0.41356530 0.17186764 0.00286716      	#	15     	Pt15
        0.16356983 0.42175769 0.00274427      	#	16     	Pt16
        0.74710708 0.75483943 0.08173360      	#	17     	Pt17
        0.74751242 0.50483691 0.08151211      	#	18     	Pt18
        0.49695101 0.75499850 0.08196400      	#	19     	Pt19
        0.99759781 0.50463876 0.08202800      	#	20     	Pt20
        0.49708230 0.00485053 0.08167357      	#	21     	Pt21
        0.24699271 0.25536777 0.08203174      	#	22     	Pt22
        0.24701172 0.00545700 0.08156433      	#	23     	Pt23
        0.99777070 0.25520402 0.08186057      	#	24     	Pt24
        0.49708643 0.50500995 0.08204114      	#	25     	Pt25
        0.24739159 0.75477647 0.08187583      	#	26     	Pt26
        0.24691915 0.50451964 0.08186384      	#	27     	Pt27
        0.99747493 0.75434417 0.08176236      	#	28     	Pt28
        0.74710222 0.25485728 0.08169524      	#	29     	Pt29
        0.74711191 0.00515931 0.08170361      	#	30     	Pt30
        0.49642676 0.25533577 0.08188076      	#	31     	Pt31
        0.99704690 0.00505019 0.08166149      	#	32     	Pt32
        0.33064537 0.33787686 0.16004531      	#	33     	Pt33
        0.08165434 0.58648461 0.15973172      	#	34     	Pt34
        0.08200100 0.33750920 0.15984585      	#	35     	Pt35
        0.83104227 0.58693928 0.15920103      	#	36     	Pt36
        0.58147287 0.08717335 0.15897736      	#	37     	Pt37
        0.58138560 0.83697189 0.15914270      	#	38     	Pt38
        0.33133977 0.08662822 0.15907567      	#	39     	Pt39
        0.83149992 0.83710304 0.15899627      	#	40     	Pt40
        0.58037783 0.58711123 0.15988834      	#	41     	Pt41
        0.58117865 0.33691234 0.15927348      	#	42     	Pt42
        0.33167179 0.58708825 0.15964486      	#	43     	Pt43
        0.83111576 0.33699320 0.15896903      	#	44     	Pt44
        0.33213146 0.83491341 0.16005329      	#	45     	Pt45
        0.08105946 0.08713094 0.15895964      	#	46     	Pt46
        0.08097868 0.83716369 0.15892314      	#	47     	Pt47
        0.83112191 0.08723386 0.15923344      	#	48     	Pt48
        0.41696762 0.41810533 0.23887191      	#	49     	Pt49
        0.41744392 0.16644525 0.23791348      	#	50     	Pt50
        0.16551418 0.41734976 0.23912920      	#	51     	Pt51
        0.66606185 0.16812251 0.23850687      	#	52     	Pt52
        0.16504553 0.67025521 0.23792683      	#	53     	Pt53
        0.91548829 0.91882974 0.23825925      	#	54     	Pt54
        0.91370365 0.67017058 0.23819960      	#	55     	Pt55
        0.66582077 0.91825770 0.23822196      	#	56     	Pt56
        0.16587795 0.16629671 0.23806156      	#	57     	Pt57
        0.91361711 0.41864925 0.23809177      	#	58     	Pt58
        0.91551972 0.16835931 0.23837237      	#	59     	Pt59
        0.66678576 0.41757382 0.23907356      	#	60     	Pt60
        0.41573619 0.91788130 0.23815899      	#	61     	Pt61
        0.41485912 0.66418741 0.24629611      	#	62     	Pt62
        0.16551243 0.91883307 0.23810756      	#	63     	Pt63
        0.66524072 0.66865550 0.23824803      	#	64     	Pt64
        0.58751577 0.37807312 0.31000676      	#	65     	H65
        0.40702391 0.61042334 0.30488381      	#	66     	H66
        0.24815843 0.43030535 0.32543741      	#	67     	H67
        0.08516800 0.51941418 0.32358159      	#	68     	H68
        0.58530592 0.38124178 0.34621303      	#	69     	O69
        0.16440508 0.42501893 0.31847449      	#	70     	O70
        0.42243590 0.47025828 0.36840743      	#	71     	O71
        0.41997596 0.70133965 0.38381286      	#	72     	O72
        0.49052727 0.55922305 0.39997315      	#	73     	S73