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 2 3 1
Direct
        0.62229312 0.24323781 0.69125379      	#	1      	Pt1
        0.59881943 0.45582665 0.81004728      	#	2      	Pt2
        0.99392706 0.43098697 0.69424052      	#	3      	Pt3
        0.84398115 0.93424776 0.54462363      	#	4      	Pt4
        0.44183193 0.63974332 0.38933403      	#	5      	Pt5
        0.60436370 0.05497893 0.95536795      	#	6      	Pt6
        0.66407279 0.91325834 0.42128113      	#	7      	Pt7
        0.40305636 0.99583149 0.59974853      	#	8      	Pt8
        0.59578315 0.70727952 0.74455254      	#	9      	Pt9
        0.63828489 0.30224994 0.28327520      	#	10     	Pt10
        0.78220502 0.31213127 0.86621244      	#	11     	Pt11
        0.83979651 0.96851991 0.80918317      	#	12     	Pt12
        0.96780881 0.52741859 0.67981452      	#	13     	Pt13
        0.62913165 0.79920623 0.07334106      	#	14     	Pt14
        0.73679908 0.85722405 0.90106859      	#	15     	Pt15
        0.86801972 0.21843411 0.65955970      	#	16     	Pt16
        0.41600287 0.30718610 0.09906901      	#	17     	Pt17
        0.77071728 0.20723202 0.19174299      	#	18     	Pt18
        0.17810525 0.69806048 0.99864397      	#	19     	Pt19
        0.06879641 0.46930070 0.43138984      	#	20     	Pt20
        0.08403390 0.83742163 0.36100962      	#	21     	Pt21
        0.21669844 0.87703587 0.64295285      	#	22     	Pt22
        0.49157336 0.27955241 0.19807049      	#	23     	Pt23
        0.07880383 0.97405183 0.89635025      	#	24     	Pt24
        0.66751892 0.15827418 0.67576637      	#	25     	Pt25
        0.17264814 0.58769458 0.00115954      	#	26     	Pt26
        0.98791641 0.20719145 0.56896115      	#	27     	Pt27
        0.19808187 0.82803734 0.56658116      	#	28     	Pt28
        0.05148131 0.78445773 0.52195857      	#	29     	Pt29
        0.11836110 0.45331024 0.16725627      	#	30     	Pt30
        0.88003954 0.86816194 0.24979497      	#	31     	Pt31
        0.06674751 0.67314505 0.59554626      	#	32     	Pt32
        0.33659869 0.78938800 0.82787570      	#	33     	Pt33
        0.07095581 0.71479227 0.74681350      	#	34     	Pt34
        0.85497412 0.86206739 0.28470561      	#	35     	Pt35
        0.46918423 0.09025001 0.10301260      	#	36     	Pt36
        0.76061733 0.80255519 0.98741189      	#	37     	Pt37
        0.40871420 0.79364892 0.15148460      	#	38     	Pt38
        0.07223030 0.49450705 0.63097582      	#	39     	Pt39
        0.43918938 0.70538586 0.95388820      	#	40     	Pt40
        0.91012182 0.63363782 0.87547369      	#	41     	Pt41
        0.50567008 0.21225212 0.33312771      	#	42     	Pt42
        0.43855869 0.72769990 0.91303836      	#	43     	Pt43
        0.99917521 0.20656211 0.60621142      	#	44     	Pt44
        0.40440540 0.44493184 0.39347389      	#	45     	Pt45
        0.77837278 0.09175288 0.68246181      	#	46     	Pt46
        0.03329396 0.55920474 0.52017502      	#	47     	Pt47
        0.56000412 0.35259207 0.88182074      	#	48     	Pt48
        0.81649176 0.25804127 0.11879060      	#	49     	Pt49
        0.60409185 0.13527030 0.95994647      	#	50     	Pt50
        0.74340985 0.19706784 0.40086245      	#	51     	Pt51
        0.09121335 0.67328566 0.71615034      	#	52     	Pt52
        0.94860119 0.67796570 0.25086649      	#	53     	Pt53
        0.61195456 0.92441808 0.63193181      	#	54     	Pt54
        0.93051040 0.81745056 0.98928099      	#	55     	Pt55
        0.06051242 0.70963793 0.95020979      	#	56     	Pt56
        0.08028640 0.33930158 0.42978121      	#	57     	Pt57
        0.67129708 0.82716664 0.06883438      	#	58     	Pt58
        0.07313949 0.15637752 0.79693376      	#	59     	Pt59
        0.48926230 0.79147066 0.08156124      	#	60     	Pt60
        0.83635439 0.31705847 0.07541684      	#	61     	Pt61
        0.95033209 0.75475253 0.25127430      	#	62     	Pt62
        0.75142479 0.89357929 0.51557701      	#	63     	Pt63
        0.98262773 0.52202762 0.22523970      	#	64     	Pt64
        0.78795986 0.80020033 0.07124780      	#	65     	H65
        0.11636147 0.30257646 0.84770556      	#	66     	H66
        0.98885508 0.10967434 0.94730360      	#	67     	O67
        0.33296030 0.69091389 0.98124462      	#	68     	O68
        0.81403415 0.46718672 0.47287585      	#	69     	O69
        0.31135919 0.70053828 0.36145729      	#	70     	S70