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
        0.81058027 0.27739734 0.40089456      	#	1      	Pt1
        0.42538184 0.68951572 0.40207919      	#	2      	Pt2
        0.11127689 0.51762261 0.73244865      	#	3      	Pt3
        0.14808750 0.51531157 0.03234111      	#	4      	Pt4
        0.51584922 0.30536564 0.41484170      	#	5      	Pt5
        0.43897950 0.99116111 0.84399033      	#	6      	Pt6
        0.14574807 0.81278615 0.78153555      	#	7      	Pt7
        0.66562393 0.27041210 0.79851459      	#	8      	Pt8
        0.53780923 0.67873400 0.58048675      	#	9      	Pt9
        0.97457437 0.44685507 0.62312311      	#	10     	Pt10
        0.39754131 0.01236749 0.99909234      	#	11     	Pt11
        0.39440445 0.54790607 0.65461968      	#	12     	Pt12
        0.04131182 0.60057624 0.55770742      	#	13     	Pt13
        0.92808025 0.77622549 0.26994991      	#	14     	Pt14
        0.96175874 0.39635675 0.17907074      	#	15     	Pt15
        0.05779720 0.39740512 0.51959914      	#	16     	Pt16
        0.37951674 0.52949735 0.58790153      	#	17     	Pt17
        0.32382983 0.63529893 0.17473445      	#	18     	Pt18
        0.13329411 0.08653963 0.57260008      	#	19     	Pt19
        0.52077596 0.87990347 0.51804780      	#	20     	Pt20
        0.28088983 0.97927229 0.65308198      	#	21     	Pt21
        0.76263715 0.23201680 0.41747295      	#	22     	Pt22
        0.70105847 0.72511044 0.12401346      	#	23     	Pt23
        0.82105903 0.60250358 0.91860571      	#	24     	Pt24
        0.92450659 0.84636651 0.24462477      	#	25     	Pt25
        0.46549432 0.43345584 0.30150089      	#	26     	Pt26
        0.08103999 0.43161121 0.58925259      	#	27     	Pt27
        0.56547764 0.96809668 0.88930909      	#	28     	Pt28
        0.69413378 0.35829256 0.89353028      	#	29     	Pt29
        0.06263060 0.62647213 0.97029782      	#	30     	Pt30
        0.50293896 0.33612946 0.79455011      	#	31     	Pt31
        0.42203128 0.06199272 0.96331171      	#	32     	Pt32
        0.34172173 0.11593878 0.09532657      	#	33     	Pt33
        0.56176338 0.60051349 0.21600176      	#	34     	Pt34
        0.91959774 0.78991657 0.03708964      	#	35     	Pt35
        0.14972218 0.09979620 0.73646772      	#	36     	Pt36
        0.49681413 0.25534984 0.12326111      	#	37     	Pt37
        0.92422610 0.40134896 0.46556977      	#	38     	Pt38
        0.39315140 0.72455865 0.92535806      	#	39     	Pt39
        0.45019436 0.12739462 0.87932407      	#	40     	Pt40
        0.93131968 0.37774151 0.04039751      	#	41     	Pt41
        0.44921921 0.45727672 0.19664830      	#	42     	Pt42
        0.07509587 0.69687706 0.84980050      	#	43     	Pt43
        0.41871162 0.67474114 0.78109400      	#	44     	Pt44
        0.97320675 0.15316718 0.05909101      	#	45     	Pt45
        0.80420121 0.79201033 0.72803679      	#	46     	Pt46
        0.64300713 0.87198237 0.52141786      	#	47     	Pt47
        0.53971210 0.03364250 0.28534581      	#	48     	Pt48
        0.49215575 0.61288461 0.38625998      	#	49     	Pt49
        0.21709844 0.59926246 0.70989603      	#	50     	Pt50
        0.33603479 0.30770337 0.93278808      	#	51     	Pt51
        0.64511518 0.83415574 0.66958050      	#	52     	Pt52
        0.29531409 0.70761874 0.38021255      	#	53     	Pt53
        0.16807195 0.36868229 0.02528147      	#	54     	Pt54
        0.01198570 0.31428687 0.21383560      	#	55     	Pt55
        0.34457607 0.98624266 0.56129408      	#	56     	Pt56
        0.38306852 0.59881578 0.72238246      	#	57     	Pt57
        0.57254288 0.30306513 0.34928109      	#	58     	Pt58
        0.40689013 0.76991516 0.51527260      	#	59     	Pt59
        0.25978242 0.02911082 0.65266801      	#	60     	Pt60
        0.48797078 0.31689937 0.53018585      	#	61     	Pt61
        0.97931198 0.46088328 0.18031760      	#	62     	Pt62
        0.05701412 0.49529713 0.27484332      	#	63     	Pt63
        0.59624056 0.89738707 0.76867351      	#	64     	Pt64
        0.40041592 0.04886064 0.05641085      	#	65     	H65
        0.45446598 0.26152527 0.29951148      	#	66     	H66
        0.01951575 0.39546294 0.14816415      	#	67     	O67
        0.55896626 0.19905230 0.39709236      	#	68     	O68
        0.33841021 0.50583112 0.56209561      	#	69     	O69
        0.11199995 0.69900924 0.46340242      	#	70     	S70