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
        0.66292547 0.67314818 0.00430582      	#	1      	Pt1
        0.41292547 0.92314818 0.00430582      	#	2      	Pt2
        0.41292547 0.67314818 0.00430582      	#	3      	Pt3
        0.16292547 0.92314818 0.00430582      	#	4      	Pt4
        0.91292547 0.42314818 0.00430582      	#	5      	Pt5
        0.91292547 0.17314818 0.00430582      	#	6      	Pt6
        0.66292547 0.42314818 0.00430582      	#	7      	Pt7
        0.16292547 0.17314818 0.00430582      	#	8      	Pt8
        0.91292547 0.92314818 0.00430582      	#	9      	Pt9
        0.91292547 0.67314818 0.00430582      	#	10     	Pt10
        0.66292547 0.92314818 0.00430582      	#	11     	Pt11
        0.16292547 0.67314818 0.00430582      	#	12     	Pt12
        0.66292547 0.17314818 0.00430582      	#	13     	Pt13
        0.41292547 0.42314818 0.00430582      	#	14     	Pt14
        0.41292547 0.17314818 0.00430582      	#	15     	Pt15
        0.16292547 0.42314818 0.00430582      	#	16     	Pt16
        0.74625547 0.75647818 0.08220142      	#	17     	Pt17
        0.74625547 0.50647818 0.08220142      	#	18     	Pt18
        0.49625547 0.75647818 0.08220142      	#	19     	Pt19
        0.99625547 0.50647818 0.08220142      	#	20     	Pt20
        0.49625547 0.00647818 0.08220142      	#	21     	Pt21
        0.24625547 0.25647818 0.08220142      	#	22     	Pt22
        0.24625547 0.00647818 0.08220142      	#	23     	Pt23
        0.99625547 0.25647818 0.08220142      	#	24     	Pt24
        0.49625547 0.50647818 0.08220142      	#	25     	Pt25
        0.24625547 0.75647818 0.08220142      	#	26     	Pt26
        0.24625547 0.50647818 0.08220142      	#	27     	Pt27
        0.99625547 0.75647818 0.08220142      	#	28     	Pt28
        0.74625547 0.25647818 0.08220142      	#	29     	Pt29
        0.74625547 0.00647818 0.08220142      	#	30     	Pt30
        0.49625547 0.25647818 0.08220142      	#	31     	Pt31
        0.99625547 0.00647818 0.08220142      	#	32     	Pt32
        0.32997047 0.33901485 0.16109548      	#	33     	Pt33
        0.08085881 0.58755318 0.16056120      	#	34     	Pt34
        0.08160381 0.33858151 0.16060352      	#	35     	Pt35
        0.83052881 0.58796318 0.15996081      	#	36     	Pt36
        0.58082047 0.08801651 0.15970954      	#	37     	Pt37
        0.58069714 0.83793318 0.15990129      	#	38     	Pt38
        0.33066214 0.08775485 0.15974128      	#	39     	Pt39
        0.83084214 0.83828651 0.15974524      	#	40     	Pt40
        0.58065047 0.58780151 0.15997271      	#	41     	Pt41
        0.57974381 0.33826985 0.16018430      	#	42     	Pt42
        0.33110381 0.58758985 0.16036151      	#	43     	Pt43
        0.83076714 0.33770485 0.15961035      	#	44     	Pt44
        0.33026881 0.83801318 0.15981004      	#	45     	Pt45
        0.08023547 0.08827485 0.15978624      	#	46     	Pt46
        0.08034214 0.83836985 0.15958655      	#	47     	Pt47
        0.83053214 0.08830151 0.15997006      	#	48     	Pt48
        0.41781881 0.41953985 0.24040346      	#	49     	Pt49
        0.41717214 0.16630818 0.23860756      	#	50     	Pt50
        0.16380047 0.41844985 0.24090335      	#	51     	Pt51
        0.66624214 0.16806151 0.23912200      	#	52     	Pt52
        0.16438214 0.67189651 0.23868162      	#	53     	Pt53
        0.91503047 0.91957485 0.23926218      	#	54     	Pt54
        0.91278381 0.67125151 0.23905588      	#	55     	Pt55
        0.66541714 0.91889318 0.23920002      	#	56     	Pt56
        0.16540214 0.16686151 0.23890776      	#	57     	Pt57
        0.91284881 0.41936818 0.23893157      	#	58     	Pt58
        0.91493881 0.16938318 0.23928598      	#	59     	Pt59
        0.66621547 0.41955985 0.23959015      	#	60     	Pt60
        0.41520381 0.91863318 0.23922647      	#	61     	Pt61
        0.41560214 0.67049985 0.23978984      	#	62     	Pt62
        0.16521714 0.91912651 0.23921457      	#	63     	Pt63
        0.66464714 0.66959485 0.23932037      	#	64     	Pt64
        0.62403381 0.38492485 0.31528650      	#	65     	H65
        0.41282714 0.62443651 0.31404471      	#	66     	H66
        0.24896881 0.42865818 0.32593892      	#	67     	H67
        0.08421047 0.52098485 0.32423030      	#	68     	H68
        0.59460214 0.39967818 0.34577584      	#	69     	O69
        0.16154047 0.42708485 0.31840089      	#	70     	O70
        0.42420045 0.44249810 0.34663074      	#	71     	O71
        0.41987211 0.66065310 0.36579188      	#	72     	O72
        0.48409878 0.50440643 0.37515358      	#	73     	S73