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
        0.66442328 0.67055691 0.00258349      	#	1      	Pt1
        0.41442328 0.92055691 0.00258349      	#	2      	Pt2
        0.41442328 0.67055691 0.00258349      	#	3      	Pt3
        0.16442328 0.92055691 0.00258349      	#	4      	Pt4
        0.91442328 0.42055691 0.00258349      	#	5      	Pt5
        0.91442328 0.17055691 0.00258349      	#	6      	Pt6
        0.66442328 0.42055691 0.00258349      	#	7      	Pt7
        0.16442328 0.17055691 0.00258349      	#	8      	Pt8
        0.91442328 0.92055691 0.00258349      	#	9      	Pt9
        0.91442328 0.67055691 0.00258349      	#	10     	Pt10
        0.66442328 0.92055691 0.00258349      	#	11     	Pt11
        0.16442328 0.67055691 0.00258349      	#	12     	Pt12
        0.66442328 0.17055691 0.00258349      	#	13     	Pt13
        0.41442328 0.42055691 0.00258349      	#	14     	Pt14
        0.41442328 0.17055691 0.00258349      	#	15     	Pt15
        0.16442328 0.42055691 0.00258349      	#	16     	Pt16
        0.74775328 0.75388691 0.08047909      	#	17     	Pt17
        0.74775328 0.50388691 0.08047909      	#	18     	Pt18
        0.49775328 0.75388691 0.08047909      	#	19     	Pt19
        0.99775328 0.50388691 0.08047909      	#	20     	Pt20
        0.49775328 0.00388691 0.08047909      	#	21     	Pt21
        0.24775328 0.25388691 0.08047909      	#	22     	Pt22
        0.24775328 0.00388691 0.08047909      	#	23     	Pt23
        0.99775328 0.25388691 0.08047909      	#	24     	Pt24
        0.49775328 0.50388691 0.08047909      	#	25     	Pt25
        0.24775328 0.75388691 0.08047909      	#	26     	Pt26
        0.24775328 0.50388691 0.08047909      	#	27     	Pt27
        0.99775328 0.75388691 0.08047909      	#	28     	Pt28
        0.74775328 0.25388691 0.08047909      	#	29     	Pt29
        0.74775328 0.00388691 0.08047909      	#	30     	Pt30
        0.49775328 0.25388691 0.08047909      	#	31     	Pt31
        0.99775328 0.00388691 0.08047909      	#	32     	Pt32
        0.33101828 0.33663691 0.15910072      	#	33     	Pt33
        0.08218328 0.58535191 0.15886268      	#	34     	Pt34
        0.08273828 0.33653691 0.15900550      	#	35     	Pt35
        0.83175328 0.58594191 0.15825170      	#	36     	Pt36
        0.58212828 0.08598191 0.15800572      	#	37     	Pt37
        0.58201828 0.83587191 0.15818426      	#	38     	Pt38
        0.33197328 0.08559691 0.15808507      	#	39     	Pt39
        0.83211328 0.83613191 0.15801763      	#	40     	Pt40
        0.58193828 0.58569691 0.15827154      	#	41     	Pt41
        0.58165828 0.33582191 0.15820806      	#	42     	Pt42
        0.33217828 0.58586191 0.15840643      	#	43     	Pt43
        0.83212828 0.33564691 0.15794621      	#	44     	Pt44
        0.33163328 0.83591191 0.15814855      	#	45     	Pt45
        0.08153328 0.08617691 0.15804540      	#	46     	Pt46
        0.08151328 0.83630191 0.15789067      	#	47     	Pt47
        0.83186328 0.08607691 0.15831121      	#	48     	Pt48
        0.41868328 0.41777191 0.23759936      	#	49     	Pt49
        0.41818328 0.16497691 0.23697252      	#	50     	Pt50
        0.16540828 0.41694191 0.23935295      	#	51     	Pt51
        0.66701328 0.16685691 0.23756366      	#	52     	Pt52
        0.16569328 0.67014191 0.23698839      	#	53     	Pt53
        0.91603828 0.91797691 0.23755572      	#	54     	Pt54
        0.91397828 0.66958691 0.23733355      	#	55     	Pt55
        0.66641828 0.91743191 0.23748034      	#	56     	Pt56
        0.16641328 0.16535691 0.23719072      	#	57     	Pt57
        0.91391328 0.41787691 0.23726214      	#	58     	Pt58
        0.91598328 0.16776191 0.23756366      	#	59     	Pt59
        0.66693328 0.41787191 0.23777790      	#	60     	Pt60
        0.41633828 0.91705191 0.23751208      	#	61     	Pt61
        0.41653328 0.66855191 0.23801197      	#	62     	Pt62
        0.16619828 0.91759191 0.23747637      	#	63     	Pt63
        0.66566828 0.66799691 0.23760333      	#	64     	Pt64
        0.56428828 0.37216691 0.32145397      	#	65     	H65
        0.40620828 0.57828191 0.31587186      	#	66     	H66
        0.25029328 0.42970691 0.32487782      	#	67     	H67
        0.08493828 0.51706691 0.32286239      	#	68     	H68
        0.51335328 0.41610691 0.34309605      	#	69     	O69
        0.16456828 0.42508691 0.31654632      	#	70     	O70
        0.45802820 0.49406667 0.38971458      	#	71     	O71
        0.42328320 0.72597167 0.40127157      	#	72     	O72
        0.50404320 0.57693167 0.40679020      	#	73     	S73