No title
    1.0
            23.46002000 0.00000000 0.00000000 
            0.00000000 10.57808000 0.00000000 
            0.00000000 1.64321125 10.11785387 
  Zr O Si N C H
  32 66 1 1 5 17
Direct
        0.17614528 0.11402951 0.36898421      	#	1      	Zr1
        0.59261050 0.42271240 0.16244564      	#	2      	Zr2
        0.39264302 0.12327173 0.37303790      	#	3      	Zr3
        0.37131150 0.41351498 0.14989248      	#	4      	Zr4
        0.28064113 0.16539442 0.15567806      	#	5      	Zr5
        0.48478192 0.37112297 0.37121957      	#	6      	Zr6
        0.50987222 0.16435937 0.14971080      	#	7      	Zr7
        0.25446155 0.37183519 0.37173638      	#	8      	Zr8
        0.17612939 0.11399110 0.86872310      	#	9      	Zr9
        0.60036518 0.42666693 0.64818891      	#	10     	Zr10
        0.39284383 0.12368300 0.87321514      	#	11     	Zr11
        0.37127799 0.41349158 0.65073791      	#	12     	Zr12
        0.28072299 0.16537116 0.65564581      	#	13     	Zr13
        0.48693671 0.37171818 0.86928510      	#	14     	Zr14
        0.51005369 0.16524212 0.65060119      	#	15     	Zr15
        0.25432712 0.37186359 0.87176308      	#	16     	Zr16
        0.17606203 0.61339954 0.36960628      	#	17     	Zr17
        0.58583704 0.91809533 0.15687091      	#	18     	Zr18
        0.39206852 0.62109916 0.37422877      	#	19     	Zr19
        0.37019776 0.91476353 0.15073954      	#	20     	Zr20
        0.28058873 0.66522767 0.15621554      	#	21     	Zr21
        0.48144154 0.86989158 0.36925919      	#	22     	Zr22
        0.50840528 0.66002382 0.15343837      	#	23     	Zr23
        0.25396525 0.87182927 0.37176778      	#	24     	Zr24
        0.17608997 0.61357713 0.86938669      	#	25     	Zr25
        0.58573023 0.91905565 0.65599100      	#	26     	Zr26
        0.39229308 0.62097182 0.87430569      	#	27     	Zr27
        0.37027557 0.91467477 0.65081960      	#	28     	Zr28
        0.28067656 0.66534144 0.65615045      	#	29     	Zr29
        0.48135240 0.86995339 0.86894718      	#	30     	Zr30
        0.50945642 0.65706407 0.65312654      	#	31     	Zr31
        0.25403194 0.87187067 0.87167605      	#	32     	Zr32
        0.22811338 0.18071380 0.48737981      	#	33     	O1
        0.54034007 0.34634963 0.03364962      	#	34     	O2
        0.46171095 0.18584088 0.47657832      	#	35     	O3
        0.30140144 0.35254362 0.04785855      	#	36     	O4
        0.34584705 0.10284548 0.04734321      	#	37     	O5
        0.41802665 0.43484532 0.47840899      	#	38     	O6
        0.58056734 0.09100196 0.06158778      	#	39     	O7
        0.17948980 0.43586930 0.45737662      	#	40     	O8
        0.32703346 0.25938849 0.29092074      	#	41     	O9
        0.43538320 0.27749495 0.23441991      	#	42     	O10
        0.54995966 0.26706334 0.27794259      	#	43     	O11
        0.21094402 0.26854994 0.24485720      	#	44     	O12
        0.21886955 0.03119267 0.23887588      	#	45     	O13
        0.54655936 0.50556757 0.29216463      	#	46     	O14
        0.43889809 0.02817363 0.23367626      	#	47     	O15
        0.32385402 0.50752733 0.29052128      	#	48     	O16
        0.22807342 0.18065731 0.98724502      	#	49     	O17
        0.54215553 0.35073650 0.53556469      	#	50     	O18
        0.46214007 0.18533387 0.97416874      	#	51     	O19
        0.30160089 0.35250630 0.54827365      	#	52     	O20
        0.34568899 0.10254808 0.54714111      	#	53     	O21
        0.41862174 0.43464795 0.97716014      	#	54     	O22
        0.57992032 0.09151702 0.56089338      	#	55     	O23
        0.17945739 0.43590179 0.95718819      	#	56     	O24
        0.32740673 0.25948310 0.79083075      	#	57     	O25
        0.43660220 0.27819101 0.73418144      	#	58     	O26
        0.55454418 0.26922692 0.77187206      	#	59     	O27
        0.21103665 0.26851856 0.74477926      	#	60     	O28
        0.21890586 0.03116553 0.73875644      	#	61     	O29
        0.55098847 0.50132653 0.78350043      	#	62     	O30
        0.43896917 0.02841246 0.73383808      	#	63     	O31
        0.32408088 0.50756826 0.79051857      	#	64     	O32
        0.22777978 0.68059496 0.48801685      	#	65     	O33
        0.53288593 0.85186573 0.03964279      	#	66     	O34
        0.45981082 0.68403127 0.47796880      	#	67     	O35
        0.30085978 0.85246316 0.04835333      	#	68     	O36
        0.34570318 0.60105190 0.04796348      	#	69     	O37
        0.41675553 0.93642382 0.47706984      	#	70     	O38
        0.57888370 0.59992017 0.06497122      	#	71     	O39
        0.17914539 0.93664179 0.45719122      	#	72     	O40
        0.32622243 0.75917738 0.29192197      	#	73     	O41
        0.43373292 0.77672033 0.23526352      	#	74     	O42
        0.54984536 0.76533319 0.28189844      	#	75     	O43
        0.21043686 0.76805842 0.24527228      	#	76     	O44
        0.21913297 0.53098975 0.23945906      	#	77     	O45
        0.54407295 0.00360347 0.28639447      	#	78     	O46
        0.44003253 0.52707628 0.23520335      	#	79     	O47
        0.32337090 0.00835049 0.29045527      	#	80     	O48
        0.22774892 0.68058313 0.98799957      	#	81     	O49
        0.53334660 0.85027325 0.53944286      	#	82     	O50
        0.45977648 0.68447145 0.97717764      	#	83     	O51
        0.30091441 0.85240665 0.54828397      	#	84     	O52
        0.34572528 0.60078240 0.54838544      	#	85     	O53
        0.41663579 0.93625005 0.97700709      	#	86     	O54
        0.58097537 0.59702792 0.56023928      	#	87     	O55
        0.17913831 0.93665796 0.95701037      	#	88     	O56
        0.32630031 0.75927046 0.79190125      	#	89     	O57
        0.43398269 0.77657067 0.73451789      	#	90     	O58
        0.54996657 0.76451055 0.78107847      	#	91     	O59
        0.21046662 0.76812703 0.74523780      	#	92     	O60
        0.21924528 0.53107567 0.73944131      	#	93     	O61
        0.54410986 0.00403048 0.78647209      	#	94     	O62
        0.44153198 0.52766735 0.73610208      	#	95     	O63
        0.32337842 0.00841704 0.79047233      	#	96     	O64
        0.67674140 0.39442158 0.19569460      	#	97     	O65
        0.69608950 0.41409964 0.63095109      	#	98     	O66
        0.76332460 0.42802194 0.65392937      	#	99     	Si
        0.80613829 0.35001667 0.23984675      	#	100    	N
        0.78484282 0.34239828 0.82440641      	#	101    	C1
        0.83161517 0.35900951 0.57099080      	#	102    	C2
        0.78334095 0.60698926 0.62025412      	#	103    	C3
        0.84268139 0.46403903 0.21143837      	#	104    	C4
        0.83117299 0.22464851 0.29091758      	#	105    	C5
        0.76373876 0.24818056 0.83181958      	#	106    	H1
        0.83124115 0.32354255 0.83186750      	#	107    	H2
        0.77171376 0.38482417 0.91115490      	#	108    	H3
        0.83682429 0.25384582 0.59050326      	#	109    	H4
        0.84305643 0.39125042 0.46706084      	#	110    	H5
        0.86640319 0.39578902 0.62912965      	#	111    	H6
        0.77399610 0.65266422 0.70837408      	#	112    	H7
        0.82915656 0.62432928 0.59353211      	#	113    	H8
        0.75738686 0.65746197 0.53693958      	#	114    	H9
        0.88445121 0.44163397 0.16912204      	#	115    	H10
        0.82073052 0.53935255 0.14176924      	#	116    	H11
        0.84865418 0.50008349 0.30664673      	#	117    	H12
        0.83370869 0.21793284 0.39970272      	#	118    	H13
        0.80319593 0.14658324 0.26896914      	#	119    	H14
        0.87442695 0.21371083 0.24979314      	#	120    	H15
        0.77377018 0.34937608 0.17540786      	#	121    	H16
        0.69915901 0.38724602 0.27640508      	#	122    	H17