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
        0.17527544 0.11413045 0.36738719      	#	1      	Zr1
        0.59065069 0.42028053 0.15571995      	#	2      	Zr2
        0.39172426 0.12321977 0.37188227      	#	3      	Zr3
        0.37036740 0.41364984 0.14791893      	#	4      	Zr4
        0.27970464 0.16553361 0.15424757      	#	5      	Zr5
        0.48405331 0.37100335 0.36959369      	#	6      	Zr6
        0.50865804 0.16433445 0.15007953      	#	7      	Zr7
        0.25349573 0.37191200 0.37013464      	#	8      	Zr8
        0.17525112 0.11410405 0.86710646      	#	9      	Zr9
        0.59903804 0.42526014 0.64737080      	#	10     	Zr10
        0.39215959 0.12382371 0.87214044      	#	11     	Zr11
        0.37011893 0.41359407 0.64884748      	#	12     	Zr12
        0.27979474 0.16541572 0.65434715      	#	13     	Zr13
        0.48524791 0.37187081 0.86556754      	#	14     	Zr14
        0.50954960 0.16560490 0.64929077      	#	15     	Zr15
        0.25337468 0.37191509 0.87028841      	#	16     	Zr16
        0.17519791 0.61350492 0.36802557      	#	17     	Zr17
        0.58467829 0.91898764 0.15505453      	#	18     	Zr18
        0.39123478 0.62108907 0.37285668      	#	19     	Zr19
        0.36922658 0.91481455 0.14893202      	#	20     	Zr20
        0.27969088 0.66534018 0.15476287      	#	21     	Zr21
        0.48044527 0.86972203 0.36788725      	#	22     	Zr22
        0.50761122 0.65980030 0.15192909      	#	23     	Zr23
        0.25298228 0.87190637 0.37026863      	#	24     	Zr24
        0.17522551 0.61364664 0.86781279      	#	25     	Zr25
        0.58481129 0.91927540 0.65444716      	#	26     	Zr26
        0.39150994 0.62103740 0.87300926      	#	27     	Zr27
        0.36925830 0.91480882 0.64935644      	#	28     	Zr28
        0.27975299 0.66552740 0.65475528      	#	29     	Zr29
        0.48036656 0.87007073 0.86717449      	#	30     	Zr30
        0.50864340 0.65773663 0.65109007      	#	31     	Zr31
        0.25306150 0.87195570 0.87016821      	#	32     	Zr32
        0.22726004 0.18070415 0.48573935      	#	33     	O1
        0.53828654 0.34962472 0.03085156      	#	34     	O2
        0.46100260 0.18613626 0.47513485      	#	35     	O3
        0.30053827 0.35263928 0.04643237      	#	36     	O4
        0.34503953 0.10285429 0.04588404      	#	37     	O5
        0.41722348 0.43476780 0.47664770      	#	38     	O6
        0.57996961 0.09311069 0.06155622      	#	39     	O7
        0.17855272 0.43588635 0.45554052      	#	40     	O8
        0.32631579 0.25944321 0.28939308      	#	41     	O9
        0.43502838 0.27770654 0.23274198      	#	42     	O10
        0.55070763 0.26701748 0.27601481      	#	43     	O11
        0.21008814 0.26860462 0.24325276      	#	44     	O12
        0.21800487 0.03131313 0.23723592      	#	45     	O13
        0.54589502 0.50363357 0.28610990      	#	46     	O14
        0.43803551 0.02840278 0.23203274      	#	47     	O15
        0.32306038 0.50757380 0.28892172      	#	48     	O16
        0.22722667 0.18065100 0.98562322      	#	49     	O17
        0.54090950 0.35143579 0.53266663      	#	50     	O18
        0.46170652 0.18629380 0.97300522      	#	51     	O19
        0.30061240 0.35258208 0.54676592      	#	52     	O20
        0.34478333 0.10249709 0.54564423      	#	53     	O21
        0.41797651 0.43480406 0.97566545      	#	54     	O22
        0.57937541 0.09187274 0.55962768      	#	55     	O23
        0.17848804 0.43589408 0.95537000      	#	56     	O24
        0.32656298 0.25950808 0.78945476      	#	57     	O25
        0.43564862 0.27840078 0.73237245      	#	58     	O26
        0.55334775 0.26898868 0.77159788      	#	59     	O27
        0.21018059 0.26857257 0.74320555      	#	60     	O28
        0.21803257 0.03127187 0.73709419      	#	61     	O29
        0.54895655 0.50212481 0.78156611      	#	62     	O30
        0.43808805 0.02868536 0.73227755      	#	63     	O31
        0.32323078 0.50768183 0.78915181      	#	64     	O32
        0.22691423 0.68061929 0.48641258      	#	65     	O33
        0.53230809 0.85153976 0.03749038      	#	66     	O34
        0.45905598 0.68388232 0.47640312      	#	67     	O35
        0.29996718 0.85259054 0.04689164      	#	68     	O36
        0.34488956 0.60104537 0.04654818      	#	69     	O37
        0.41573316 0.93626325 0.47528289      	#	70     	O38
        0.57952870 0.59745474 0.06282407      	#	71     	O39
        0.17819232 0.93666118 0.45534952      	#	72     	O40
        0.32550577 0.75929569 0.29040265      	#	73     	O41
        0.43325248 0.77642650 0.23293935      	#	74     	O42
        0.54914910 0.76498713 0.27949148      	#	75     	O43
        0.20958354 0.76807050 0.24370927      	#	76     	O44
        0.21829222 0.53111452 0.23784617      	#	77     	O45
        0.54270883 0.00355131 0.28491567      	#	78     	O46
        0.43940523 0.52738201 0.23393773      	#	79     	O47
        0.32250020 0.00844600 0.28891188      	#	80     	O48
        0.22688401 0.68060857 0.98641062      	#	81     	O49
        0.53252947 0.85027728 0.53770820      	#	82     	O50
        0.45917083 0.68441033 0.97592927      	#	83     	O51
        0.30001570 0.85252990 0.54682611      	#	84     	O52
        0.34480792 0.60079939 0.54684126      	#	85     	O53
        0.41578658 0.93637451 0.97536416      	#	86     	O54
        0.58023655 0.59783965 0.55700248      	#	87     	O55
        0.17816929 0.93673508 0.95516111      	#	88     	O56
        0.32544455 0.75939523 0.79050718      	#	89     	O57
        0.43318829 0.77641751 0.73287068      	#	90     	O58
        0.54905367 0.76444204 0.77921831      	#	91     	O59
        0.20957535 0.76815834 0.74365349      	#	92     	O60
        0.21840537 0.53117339 0.73785050      	#	93     	O61
        0.54306599 0.00412593 0.78478649      	#	94     	O62
        0.44062983 0.52776635 0.73425840      	#	95     	O63
        0.32253462 0.00858937 0.78907999      	#	96     	O64
        0.68391650 0.38329547 0.19619436      	#	97     	O65
        0.70044285 0.41439997 0.62184777      	#	98     	O66
        0.77387797 0.42689799 0.64978251      	#	99     	Si
        0.80605370 0.35590792 0.26561962      	#	100    	N
        0.78645556 0.33271906 0.82047017      	#	101    	C1
        0.84428530 0.36205127 0.57688182      	#	102    	C2
        0.78892156 0.60770909 0.61841199      	#	103    	C3
        0.84494322 0.46310097 0.22950556      	#	104    	C4
        0.83192900 0.23078015 0.30876613      	#	105    	C5
        0.75912830 0.24838290 0.82291342      	#	106    	H1
        0.83068766 0.29933162 0.82929843      	#	107    	H2
        0.77611350 0.37835375 0.90568793      	#	108    	H3
        0.85089048 0.25798788 0.59544547      	#	109    	H4
        0.86138655 0.39554725 0.47879610      	#	110    	H5
        0.87482435 0.39883095 0.64442065      	#	111    	H6
        0.78154071 0.64821306 0.70918486      	#	112    	H7
        0.83362478 0.62584292 0.58706668      	#	113    	H8
        0.76104550 0.65893262 0.54046231      	#	114    	H9
        0.88716585 0.43609703 0.19273584      	#	115    	H10
        0.82454166 0.53444937 0.15500308      	#	116    	H11
        0.85471098 0.51590018 0.31241831      	#	117    	H12
        0.83515014 0.20528871 0.41741542      	#	118    	H13
        0.80416580 0.15721167 0.27935361      	#	119    	H14
        0.87606533 0.22029829 0.27174970      	#	120    	H15
        0.73970568 0.36124111 0.17413914      	#	121    	H16
        0.69990847 0.38638797 0.28688311      	#	122    	H17