Mutinaite
van Koningsveld H
Acta Crystallographica B46 (1990) 731-735
High-temperature (350 K) orthorhombic framework structure of zeolite H-ZSM-5
Locality: synthetic
Note: anisotropic thermal parameters obtained from ICSD
_database_code_amcsd 0009842
20.078 19.894 13.372 90 90 90 Pnma
atom      x      y      z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .42292 .05678 .66492  .0130  .0140  .0179  .0011 -.0016 -.0003
Si2  .30840 .02897 .81293  .0166  .0166  .0180 -.0001  .0041 -.0003
Si3  .27919 .06191 .03257  .0170  .0159  .0178  .0014 -.0007 -.0043
Si4  .12228 .06397 .02834  .0164  .0146  .0143  .0000  .0012 -.0015
Si5  .07168 .02825 .81584  .0127  .0134  .0152 -.0010  .0025 -.0006
Si6  .18703 .05906 .67398  .0161  .0160  .0182  .0001  .0050  .0039
Si7  .42346 .82787 .67664  .0133  .0106  .0183  .0010  .0019  .0012
Si8  .30861 .87080 .81794  .0175  .0153  .0161 -.0005  .0026 -.0009
Si9  .27417 .82731 .03341  .0168  .0099  .0166 -.0018 -.0005 -.0001
Si10 .11963 .82675 .02992  .0172  .0112  .0168  .0019 -.0004  .0005
Si11 .07045 .87019 .81795  .0126  .0146  .0178  .0006 -.0007  .0017
Si12 .18803 .82715 .68326  .0178  .0131  .0189 -.0008  .0034 -.0017
O1    .3725  .0555 -.2437   .024   .065   .044  -.009   .017  -.003
O2    .3093  .0594 -.0776   .044   .046   .022  -.008   .008  -.009
O3    .2007  .0595  .0284   .017   .070   .074   .002   .001  -.013
O4    .0953  .0633 -.0831   .063   .032   .024  -.005  -.013  -.002
O5    .1160  .0541 -.2747   .022   .050   .028  -.001   .011   .017
O6    .2433  .0533 -.2435   .030   .072   .041   .011  -.009   .006
O7    .3741 -.1566 -.2335   .028   .063   .034   .009   .014  -.004
O8    .3085 -.1559 -.0699   .038   .062   .026   .003   .009   .016
O9    .1969 -.1545  .0271   .018   .031   .063   .000   .003   .005
O10   .0887 -.1629 -.0781   .057   .048   .034  -.007  -.017   .019
O11   .1176 -.1576 -.2672   .025   .051   .047   .007   .011  -.014
O12   .2448 -.1556 -.2388   .027   .075   .050  -.010  -.010  -.008
O13   .3087 -.0499 -.1822   .111   .015   .072   .002   .002   .000
O14   .0786 -.0510 -.1728   .050   .015   .063   .003  -.004   .001
O15   .4175  .1269 -.3908   .046   .016   .052   .002  -.023   .011
O16   .4079 -.0021 -.4120   .065   .026   .038  -.003  -.015  -.008
O17   .4006 -.1329 -.4221   .057   .021   .028   .004  -.011   .009
O18   .1913  .1302 -.3801   .046   .021   .037  -.001   .013   .008
O19   .1944  .0004 -.4062   .064   .028   .046   .008   .004  -.013
O20   .1965 -.1297 -.4158   .072   .022   .031  -.010   .013   .009
O21  -.0035  .0490 -.2077   .016   .043   .032   .007   .002   .000
O22  -.0045 -.1490 -.2104   .019   .052   .031  -.008   .001   .001
O23   .4227   -.25 -.3491   .062   .010   .040      0  -.004      0
O24   .1924   -.25 -.3480   .051   .014   .037      0   .015      0
O25   .2841   -.25  .0596   .039   .012   .034      0  -.009      0
O26   .1100   -.25  .0620   .044   .012   .027      0   .001      0