Terranovaite
	Galli E, Quartieri S, Vezzalini G, Alberti A, Franzini M
	American Mineralogist 82 (1997) 423-429
	Terranovaite from Antarctica: A new 'pentasil' zeolite
	_database_code_amcsd 0001886
	9.747 23.880 20.068 90 90 90 Cmcm
	atom x y z occ Biso
	Si1 0 .4524 .3281 .85 1.01
	Al1 0 .4524 .3281 .15 1.01
	Si2 0 .5440 .4396 .85 1.18
	Al2 0 .5440 .4396 .15 1.18
	Si3 .7919 .3604 .3728 .85 1.28
	Al3 .7919 .3604 .3728 .15 1.28
	Si4 .7917 .6392 .4694 .85 1.13
	Al4 .7917 .6392 .4694 .15 1.13
	Si5 0 .1806 .4414 .85 1.07
	Al5 0 .1806 .4414 .15 1.07
	Si6 0 .7321 .4365 .85 1.01
	Al6 0 .7321 .4365 .15 1.01
	Si7 0 .2697 .3272 .85 1.15
	Al7 0 .2697 .3272 .15 1.15
	Si8 0 .8252 .3289 .85 1.02
	Al8 0 .8252 .3289 .15 1.02
	O1 0 .4692 .25 3.41
	O2 0 .5113 .3679 3.97
	O3 .1367 .4160 .3453 3.74
	O4 0 .5 .5 5.66
	O5 .8630 .5836 .4415 3.97
	O6 .1958 .3683 .4512 5.04
	O7 .6325 .3623 .3488 3.16
	O8 .8661 .3057 .3415 3.47
	O9 .3663 .6374 .4453 2.34
	O10 .8655 .6932 .4377 3.03
	O11 0 .2124 .3685 2.93
	O12 0 .7751 .4970 3.09
	O13 0 .7648 .3656 2.39
	O14 0 .2515 .25 3.28
	O15 0 .8123 .25 4.01
	Na1 0 .0458 .4442 .05 .7
	Ca1 0 .0458 .4442 .05 .7
	Wat1 0 .0458 .4442 .37 .7
	Na2 0 .0403 .25 .08 1.6
	Ca2 0 .0403 .25 .08 1.6
	Wat2 0 .0403 .25 .56 1.6
	Na3 .3578 .4603 .25 .11 9.2
	Ca3 .3578 .4603 .25 .11 9.2
	Wat3 .3578 .4603 .25 .76 9.2
	Na4 .1457 .0399 .3495 .08 9.5
	Ca4 .1457 .0399 .3495 .08 9.5
	Wat4 .1457 .0399 .3495 .58 9.5
	Na5 0 .6982 .25 .06 9.5
	Ca5 0 .6982 .25 .06 9.5
	Wat5 0 .6982 .25 .44 9.5
	Na6 0 .9509 .4405 .06 9.5
	Ca6 0 .9509 .4405 .06 9.5
	Wat6 0 .9509 .4405 .44 9.5
	Na7 .9089 .1288 .25 .06 9.5
	Ca7 .9089 .1288 .25 .06 9.5
	Wat7 .9089 .1288 .25 .44 9.5
	Na8 .3519 .4804 .4598 .04 8.2
	Ca8 .3519 .4804 .4598 .04 8.2
	Wat8 .3519 .4804 .4598 .29 8.2
	Na9 0 .9651 .3547 .03 4.1
	Ca9 0 .9651 .3547 .03 4.1
	Wat9 0 .9651 .3547 .20 4.1
	Na10 0 .5972 .25 .06 11.8
	Ca10 0 .5972 .25 .06 11.8
	Wat10 0 .5972 .25 .44 11.8
	Na11 .3056 .1983 .25 .05 9.5
	Ca11 .3056 .1983 .25 .05 9.5
	Wat11 .3056 .1983 .25 .37 9.5
	Na12 .1901 .0815 .1907 .02 8.7
	Ca12 .1901 .0815 .1907 .02 8.7
	Wat12 .1901 .0815 .1907 .16 8.7
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	Scandiobabingtonite
	Orlandi P, Pasero M, Vezzalini G
	American Mineralogist 83 (1998) 1330-1334
	Scandiobabingtonite, a new mineral from the Baveno pegmatite, Piedmont, Italy
	Locality: "Montecatini" granite quarry, near Baveno, Novara, Piedmont, Italy
	_database_code_amcsd 0002052
	7.536 11.734 6.748 91.70 93.86 104.53 P-1
	atom x y z occ Biso
	Ca1 .7858 .9429 .1445 .855 .98
	Na1 .7858 .9429 .1445 .125 .98
	Ca2 .2344 .5223 .2999 .855 1.02
	Na2 .2344 .5223 .2999 .125 1.02
	Fe1 .5915 .6448 .0615 .65 .71
	Mn1 .5915 .6448 .0615 .32 .71
	Sc2 .0457 .2355 .1871 .91 .60
	Sn2 .0457 .2355 .1871 .04 .60
	Fe2 .0457 .2355 .1871 .03 .60
	Si1 .2906 .0538 .3408 .66
	Si2 .4635 .3155 .4261 .60
	Si3 .8070 .4473 .2129 .61
	Si4 .9890 .7148 .3071 .58
	Si5 .3292 .8386 .1074 .66
	OH1 .1993 .9898 .5342 1.28
	O2 .1315 .0773 .1836 .93
	O3 .4346 .1733 .4321 .90
	O4 .3230 .3416 .2478 .8
	O5 .5474 .6223 .3618 .84
	O6 .6807 .3733 .3764 .85
	O7 .9670 .3864 .1589 .86
	O8 .6767 .4744 .0311 .99
	O9 .9259 .5710 .3367 .8
	O10 .8694 .7534 .1242 .84
	O11 .0195 .2184 .4843 1.01
	O12 .2034 .7395 .2464 .84
	O13 .5106 .8003 .0577 1.00
	O14 .7992 .1380 .0795 .91
	O15 .3977 .9681 .2311 1.08
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	Bikitaite
	Ferro O, Quartieri S, Vezzalini G, Fois E, Gamba A, Tabacchi G
	American Mineralogist 87 (2002) 1415-1425
	High-pressure behaviour of bikitaite: An integrated theoretical
	and experimental approach
	Sample at P = 1 atm
	_database_code_amcsd 0002910
	8.6061 4.9573 7.5970 89.94 114.407 89.98 P1
	atom x y z
	Li1 .2965 .3307 .1531
	Li2 .6648 .8312 .8256
	Si11 .0888 .8186 .0680
	Si12 .0854 .8013 .4793
	Si22 .8563 .2972 .4525
	Si23 .6000 .3492 .0473
	Al13 .3500 .8515 .9033
	Al21 .8730 .3181 .8854
	O11 .2427 .6978 .0316
	O12 .0577 .1463 .0327
	O13 .1365 .7520 .3005
	O14 .0231 .5134 .5318
	O15 .2414 .9245 .6560
	O16 .4411 .1616 .0355
	O21 .7020 .2022 .9372
	O22 .9016 .6699 .9377
	O23 .8065 .2515 .6370
	O24 .9173 .0122 .4016
	O25 .7047 .4224 .2675
	O26 .5217 .6345 .9289
	O17 .3951 .2779 .4472
	O27 .5634 .7773 .5357
	H11 .3186 .2389 .5052
	H12 .4695 .1230 .4807
	H21 .6439 .7638 .4792
	H22 .4995 .6111 .5012
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	Bikitaite
	Ferro O, Quartieri S, Vezzalini G, Fois E, Gamba A, Tabacchi G
	American Mineralogist 87 (2002) 1415-1425
	High-pressure behaviour of bikitaite: An integrated theoretical
	and experimental approach
	Sample at P = 5.7 GPa
	_database_code_amcsd 0002911
	8.4932 4.7773 7.2443 90.804 114.794 89.442 P1
	atom x y z
	Li1 .2982 .3199 .1751
	Li2 .6555 .8082 .8008
	Si11 .0875 .7992 .0723
	Si12 .0857 .8384 .4885
	Si22 .8606 .3324 .4513
	Si23 .5999 .3498 .0468
	Al13 .3500 .8508 .9069
	Al21 .8677 .2957 .8793
	O11 .2411 .6696 .0283
	O12 .0674 .1378 .0398
	O13 .1467 .7072 .3055
	O14 .0085 .5745 .5688
	O15 .2398 .9920 .6632
	O16 .4527 .1430 .0773
	O21 .6992 .1697 .9384
	O22 .8984 .6534 .9328
	O23 .8008 .2102 .6157
	O24 .9351 .0710 .3586
	O25 .7098 .4896 .2576
	O26 .5004 .6064 .8938
	O17 .4031 .2613 .4661
	O27 .5533 .7582 .5047
	H11 .3385 .2245 .5456
	H12 .4725 .0907 .4828
	H21 .6213 .7397 .4272
	H22 .4943 .5769 .4872
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	Bikitaite
	Ferro O, Quartieri S, Vezzalini G, Fois E, Gamba A, Tabacchi G
	American Mineralogist 87 (2002) 1415-1425
	High-pressure behaviour of bikitaite: An integrated theoretical
	and experimental approach
	Sample at P = 9.0 GPa
	_database_code_amcsd 0002912
	8.231 4.7320 7.1187 92.80 114.99 88.37 P1
	atom x y z
	Li1 .3002 .2841 .1852
	Li2 .6485 .7621 .7962
	Si11 .0922 .7631 .0853
	Si12 .0941 .8915 .4982
	Si22 .8544 .3888 .4499
	Si23 .5971 .3143 .0367
	Al13 .3505 .8238 .9189
	Al21 .8657 .2567 .8645
	O11 .2467 .6216 .0366
	O12 .0772 .0977 .0223
	O13 .1479 .7189 .3288
	O14 -.0124 .6605 .5707
	O15 .2489 .0130 .6971
	O16 .4782 .0977 .1010
	O21 .6994 .1341 .9276
	O22 .8981 .6234 .9468
	O23 .7991 .2295 .6001
	O24 .9605 .1499 .3580
	O25 .7013 .5081 .2480
	O26 .4819 .5529 .8559
	O17 .4054 .2867 .4742
	O27 .5563 .7820 .4981
	H11 .3607 .3042 .5785
	H12 .4742 .1096 .5030
	H21 .6182 .8049 .4166
	H22 .4951 .6033 .4604
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	Bikitaite
	Ferro O, Quartieri S, Vezzalini G, Ceriani C, Fois E, Gamba A, Cruciani G
	American Mineralogist 89 (2004) 94-101
	Dehydration dynamics of bikitaite: I. In situ synchrotron powder X-ray diffraction study
	Sample: T = 30 C
	_database_code_amcsd 0003188
	8.6121 4.9579 7.6040 89.892 114.423 89.955 P1
	atom x y z Biso
	Li1 .270 .395 .128 4.5
	Li2 .659 .876 .831 4.5
	Al13 .373 .896 .942 3.0
	Al21 .880 .392 .910 3.0
	Si11 .086 .871 .100 3.7
	Si12 .1038 .8006 .5049 3.7
	Si22 .885 .324 .491 3.7
	Si23 .607 .385 .068 3.7
	O11 .256 .787 .068 3.1
	O12 .049 .184 .035 3.1
	O13 .152 .848 .328 3.1
	O14 .055 .496 .526 3.1
	O15 .261 .933 .690 3.1
	O16 .423 .228 .020 3.1
	O21 .714 .240 .958 2.3
	O22 .899 .732 .963 2.3
	O23 .828 .345 .667 3.1
	O24 .953 .020 .475 3.1
	O25 .738 .432 .292 3.1
	O26 .543 .678 .973 2.3
	Wat17 .412 .366 .413 3.0
	Wat27 .583 .849 .541 3.0
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	Bikitaite
	Ferro O, Quartieri S, Vezzalini G, Ceriani C, Fois E, Gamba A, Cruciani G
	American Mineralogist 89 (2004) 94-101
	Dehydration dynamics of bikitaite: I. In situ synchrotron powder X-ray diffraction study
	Sample: T = 280 C
	_database_code_amcsd 0003189
	8.6140 4.9721 7.5510 89.753 114.273 90.154 P1
	atom x y z occ Biso
	Li1 .286 .374 .128 8.3
	Li2 .674 .871 .843 8.3
	Al13 .376 .876 .924 1.2
	Al21 .883 .376 .896 1.2
	Si11 .092 .863 .080 2.2
	Si12 .1038 .8006 .5049 2.2
	Si22 .886 .321 .487 2.2
	Si23 .6120 .363 .059 2.2
	O11 .251 .756 .038 2.1
	O12 .063 .180 .021 2.1
	O13 .134 .834 .309 2.4
	O14 .051 .513 .561 2.4
	O15 .252 .952 .684 2.4
	O16 .437 .195 .018 2.1
	O21 .728 .237 .960 2.9
	O22 .912 .720 .943 2.9
	O23 .806 .352 .646 2.4
	O24 .961 .019 .497 2.4
	O25 .715 .368 .292 2.4
	O26 .554 .667 .980 2.9
	Wat17 .398 .277 .411 .66 14.
	Wat27 .542 .810 .558 .77 14.
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	Bikitaite
	Ferro O, Quartieri S, Vezzalini G, Ceriani C, Fois E, Gamba A, Cruciani G
	American Mineralogist 89 (2004) 94-101
	Dehydration dynamics of bikitaite: I. In situ synchrotron powder X-ray diffraction study
	Sample: T = 400
	_database_code_amcsd 0003190
	8.6269 4.9871 7.5718 89.765 114.097 90.160 P1
	atom x y z occ Biso
	Li1 .314 .356 .160 7.1
	Li2 .718 .844 .914 7.1
	Al13 .384 .859 .933 3.6
	Al21 .889 .336 .899 3.6
	Si11 .102 .851 .078 5.6
	Si12 .1038 .8006 .5049 5.6
	Si22 .883 .292 .484 5.6
	Si23 .617 .334 .074 5.6
	O11 .246 .706 .020 4.6
	O12 .085 .179 .029 4.6
	O13 .124 .819 .301 5.0
	O14 .024 .522 .538 5.0
	O15 .266 .882 .695 5.0
	O16 .436 .188 .014 4.6
	O21 .723 .242 .951 4.2
	O22 .936 .673 .952 4.2
	O23 .813 .343 .650 5.0
	O24 .946 .985 .489 5.0
	O25 .736 .419 .296 5.0
	O26 .550 .629 .975 4.2
	Wat17 .526 .333 .416 .36 15.
	Wat27 .633 .793 .625 .41 15.
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	Bikitaite
	Ferro O, Quartieri S, Vezzalini G, Ceriani C, Fois E, Gamba A, Cruciani G
	American Mineralogist 89 (2004) 94-101
	Dehydration dynamics of bikitaite: I. In situ synchrotron powder X-ray diffraction study
	Sample: T = 468
	_database_code_amcsd 0003191
	8.6274 4.9898 7.5729 89.737 114.072 90.169 P1
	atom x y z Biso
	Li1 .320 .352 .167 7.2
	Li2 .718 .859 .911 7.2
	Al13 .377 .874 .931 4.1
	Al21 .891 .357 .895 4.1
	Si11 .105 .866 .090 4.5
	Si12 .1038 .8006 .5049 4.5
	Si22 .886 .313 .494 4.5
	Si23 .618 .367 .068 4.5
	O11 .264 .727 .055 4.3
	O12 .083 .191 .039 4.3
	O13 .135 .808 .310 5.0
	O14 .044 .520 .559 5.0
	O15 .267 .914 .687 5.0
	O16 .445 .190 .018 4.3
	O21 .738 .246 .972 4.6
	O22 .938 .684 .972 4.6
	O23 .795 .326 .644 5.0
	O24 .954 .012 .479 5.0
	O25 .721 .380 .299 5.0
	O26 .559 .673 .997 4.6
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	Mazzite-Na
	Arletti R, Galli E, Vezzalini G, Wise W S
	American Mineralogist 90 (2005) 1186-1191
	Mazzite-Na, a new zeolite from Boron, California:
	Its description and crystal structure
	Sample: US Borax Mine, Boron, Ca
	_database_code_amcsd 0003819
	18.2343 18.2343 7.6371 90 90 120 P6_3/mmc
	atom x y z occ Uiso
	Na1 1/3 2/3 .25 .24 .06
	Na2 .5 0 0 .77 .119
	Na3 .032 .144 .040 .26 .19
	Si1 .15791 .49004 1/4 .0162
	Si2 .35457 .09295 .0457 .0162
	O1 .2580 .5161 1/4 .032
	O2 .4246 .8493 1/4 .037
	O3 .3829 .0977 1/4 .0258
	O4 .4357 .1092 -.0721 .0308
	O5 .1625 .3250 -.0046 .0284
	O6 .2727 0 0 .0275
	Wat1 .4658 .9316 .719 .44 .076
	Wat2 1/3 2/3 .963 .63 .18
	Wat2A 1/3 2/3 .056 .19 .021
	Wat3 .243 .680 3/4 .24 .13
	Wat5 .130 -.004 3/4 .46 .25
	Wat6 .089 .177 1/4 .36 .15
	Wat7 .078 -.078 3/4 .12 .07
	Wat8 .437 .874 .704 .08 .03
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	Stellerite
	Arletti R, Mazzucato E, Vezzalini G
	American Mineralogist 91 (2006) 628-634
	Influence of dehydration kinetics on T-O-T bridge breaking
	in zeolites with framework type STI: The case of stellerite
	Locality: Seremida, Sardinia, Italy
	Sample: T = 302 K
	Note: occupancies invented to match formula
	_database_code_amcsd 0004140
	13.5947 18.1823 17.8335 90 90 90 Fmmm
	atom x y z occ Uiso
	Ca .5 .0 .2920 .78 .042
	Na .5 .0 .2920 .10 .042
	K .5 .0 .2920 .01 .042
	SiT1 .3847 .3068 .3787 .88 .0337
	AlT1 .3847 .3068 .3787 .22 .0337
	SiT3 .3034 .4114 .5 .88 .0337
	AlT3 .3034 .4114 .5 .22 .0337
	SiT4 .3859 .1832 .5 .88 .0337
	AlT4 .3859 .1832 .5 .22 .0337
	SiT5 .25 .25 .25 .88 .0337
	AlT5 .25 .25 .25 .22 .0337
	O1 .3151 .3094 .2995 .043
	O3 .3716 .2353 .4265 .043
	O4 .3548 .3804 .4205 .043
	O7 .5 .3164 .3532 .043
	O8 .3179 .1121 .5 .043
	O9 .311 .5 .5 .043
	O10 .5 .148 .5 .043
	Wat1 .401 .117 .307 .27 .091
	Wat2 .5 .131 .302 .84 .091
	Wat3 .460 .0 .419 .46 .091
	Wat4 .349 .071 .330 .30 .091
	Wat5 .420 .5 .336 .64 .091
	Wat7 .315 .053 .246 .27 .091
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	Stellerite
	Arletti R, Mazzucato E, Vezzalini G
	American Mineralogist 91 (2006) 628-634
	Influence of dehydration kinetics on T-O-T bridge breaking
	in zeolites with framework type STI: The case of stellerite
	Locality: Seremida, Sardinia, Italy
	Sample: T = 503 K
	Note: occupancies invented to match formula
	_database_code_amcsd 0004141
	13.6629 17.6064 17.3629 90 90 90 Amma
	atom x y z occ Uiso
	Ca1 .25 .179 .067 .13 .083
	Na1 .25 .179 .067 .02 .083
	Ca4 .25 .5 .171 .08 .083
	Na4 .25 .5 .171 .01 .083
	Ca5 .080 .5 .093 .36 .083
	Na5 .080 .5 .093 .04 .083
	Ca6 .083 0 -.018 .20 .083
	Na6 .083 0 -.018 .03 .083
	SiT1 .1373 .3340 .1346 .88 .037
	AlT1 .1373 .3340 .1346 .22 .037
	SiT1P .1369 .2851 .3792 .88 .037
	AlT1P .1369 .2851 .3792 .22 .037
	SiT3 .0505 .4087 .2819 .88 .037
	AlT3 .0505 .4087 .2819 .22 .037
	SiT4 .1350 .1882 .2330 .88 .037
	AlT4 .1350 .1882 .2330 .22 .037
	SiT5 0 .2969 0 .88 .037
	AlT5 0 .2969 0 .22 .037
	O1 .066 .3577 .0588 .053
	O1P .064 .2658 .4557 .053
	O3 .127 .2447 .1580 .053
	O3P .117 .2164 .3188 .053
	O4 .100 .3927 .1956 .053
	O4P .117 .3672 .3470 .053
	O7 .25 .363 .103 .053
	O7P .25 .287 .410 .053
	O8 .0738 .1158 .212 .053
	O9 .047 .5 .289 .053
	O10 .25 .162 .231 .053
	Wat1 .25 0 .343 .44 .132
	Wat2 .25 .094 .431 .13 .132
	Wat3 .25 .5 .410 .83 .132
	Wat4 .25 0 .213 .44 .132
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	Stellerite
	Arletti R, Mazzucato E, Vezzalini G
	American Mineralogist 91 (2006) 628-634
	Influence of dehydration kinetics on T-O-T bridge breaking
	in zeolites with framework type STI: The case of stellerite
	Locality: Seremida, Sardinia, Italy
	Sample: T = 740 K
	Note: occupancies invented to match formula
	_database_code_amcsd 0004142
	13.5426 17.557 17.102 90 90 90 Amma
	atom x y z occ Uiso
	Ca1 .25 .243 .051 .40 .044
	Na1 .25 .243 .051 .05 .044
	Ca4 .25 .5 .187 .34 .044
	Na4 .25 .5 .187 .04 .044
	SiT1 .138 .334 .137 .55 .063
	AlT1 .138 .334 .137 .07 .063
	SiT1P .1348 .2745 .3762 .88 .063
	AlT1P .1348 .2745 .3762 .22 .063
	SiT3 .0551 .4134 .2873 .88 .063
	AlT3 .0551 .4134 .2873 .22 .063
	SiT4 .1337 .1751 .2243 .88 .063
	AlT4 .1337 .1751 .2243 .22 .063
	SiT5 0 .3091 0 .88 .063
	AlT5 0 .3091 0 .22 .063
	SiT1D .141 .4109 .116 .33 .063
	AlT1D .141 .4109 .116 .05 .063
	O1 .073 .363 .058 .084
	O1P .072 .2482 .455 .084
	O3 .128 .239 .152 .084
	O3P .123 .210 .3107 .084
	O4 .118 .396 .206 .084
	O4P .110 .3577 .345 .084
	O7 .25 .367 .100 .084
	O7P .25 .272 .406 .084
	O8 .071 .100 .214 .084
	O9 .082 .5 .310 .084
	O10 .25 .142 .221 .084
	OD .139 .5 .097 .76 .084
	Wat .25 0 .303 .61 .180
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	Gismondine
	Ori S, Quartieri S, Vezzalini G, Dmitriev V
	American Mineralogist 93 (2008) 1393-1403
	Pressure-induced over-hydration and water ordering in gismondine:
	a synchrotron powder diffraction study
	Locality: Ballyclare, Ireland
	Note: ambient pressure
	_database_code_amcsd 0004631
	10.0155 10.6051 9.8277 90 92.409 90 P2_1/c
	atom x y z occ Uiso
	Ca .7159 .0772 .3564 .052
	All .0987 .1136 .1671 .015
	Al2 .5917 .8652 .1514 .015
	Sil .4110 .1088 .1791 .015
	Si2 .9101 .870 .1618 .015
	O1 .072 .159 .9981 .005
	O2 .2608 .067 .215 .005
	O3 .435 .151 .0237 .005
	O4 .2430 .401 .302 .005
	O5 .004 .986 .217 .005
	O6 .043 .2412 .261 .005
	O7 .461 .227 .273 .005
	O8 .504 .989 .222 .005
	Watl .254 .104 .503 .022
	Wat2 .591 .122 .536 .022
	Wat3 .911 .116 .495 .022
	Wat4 .777 .239 .240 .38 .022
	Wat5 .734 .307 .410 .62 .022
	Wat6 .777 .083 .040 .15 .022
	Wat7 .760 .198 .147 .62 .022
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
	Gismondine
	Ori S, Quartieri S, Vezzalini G, Dmitriev V
	American Mineralogist 93 (2008) 1393-1403
	Pressure-induced over-hydration and water ordering in gismondine:
	a synchrotron powder diffraction study
	Locality: Ballyclare, Ireland
	Note: pressure = 1.6 GPa
	_database_code_amcsd 0004632
	9.8917 10.5948 9.7482 90 92.200 90 P2_1/c
	atom x y z occ Uiso
	Ca .7285 .0824 .3543 .070
	All .095 .113 .168 .026
	Al2 .591 .863 .151 .026
	Sil .412 .112 .183 .026
	Si2 .909 .866 .163 .026
	O1 .071 .160 .998 .016
	O2 .260 .072 .221 .016
	O3 .436 .151 .026 .016
	O4 .243 .404 .298 .016
	O5 .005 .980 .218 .016
	O6 .036 .236 .269 .016
	O7 .471 .226 .278 .016
	O8 .501 .988 .220 .016
	Watl .259 .102 .501 .033
	Wat2 .592 .125 .532 .033
	Wat3 .910 .122 .503 .033
	Wat4 .77 .274 .20 .23 .033
	Wat5 .745 .318 .360 .77 .033
	Wat6 .760 .152 .06 .50 .033
	Wat7 .767 .175 .14 .50 .033
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
	Gismondine
	Ori S, Quartieri S, Vezzalini G, Dmitriev V
	American Mineralogist 93 (2008) 1393-1403
	Pressure-induced over-hydration and water ordering in gismondine:
	a synchrotron powder diffraction study
	Locality: Ballyclare, Ireland
	Note: pressure = 1.9 GPa
	_database_code_amcsd 0004633
	9.7975 10.626 9.6977 90 91.225 90 P2_1/c
	atom x y z Uiso
	Ca .744 .0777 .346 .091
	All .096 .114 .170 .032
	Al2 .583 .860 .158 .032
	Sil .417 .108 .184 .032
	Si2 .909 .862 .163 .032
	O1 .071 .164 .000 .026
	O2 .261 .071 .220 .026
	O3 .434 .139 .022 .026
	O4 .248 .397 .303 .026
	O5 .006 .978 .212 .026
	O6 .029 .233 .271 .026
	O7 .485 .225 .267 .026
	O8 .500 .985 .236 .026
	Watl .260 .111 .497 .038
	Wat2 .597 .128 .519 .038
	Wat3 .906 .119 .514 .038
	Wat5 .764 .303 .326 .038
	Wat7 .758 .149 .099 .038
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	Gismondine
	Ori S, Quartieri S, Vezzalini G, Dmitriev V
	American Mineralogist 93 (2008) 1393-1403
	Pressure-induced over-hydration and water ordering in gismondine:
	a synchrotron powder diffraction study
	Locality: Ballyclare, Ireland
	Note: pressure = 0 after decompression
	_database_code_amcsd 0004634
	10.0264 10.6094 9.8377 90 92.369 90 P2_1/c
	atom x y z occ Uiso
	Ca .7164 .0793 .356 .071
	All .094 .112 .166 .025
	Al2 .593 .866 .148 .025
	Sil .412 .108 .181 .025
	Si2 .909 .869 .160 .025
	O1 .077 .168 .999 .013
	O2 .261 .062 .212 .013
	O3 .435 .157 .027 .013
	O4 .243 .406 .303 .013
	O5 .006 .982 .215 .013
	O6 .048 .244 .254 .013
	O7 .459 .231 .269 .013
	O8 .505 .988 .222 .013
	Watl .248 .110 .502 .035
	Wat2 .585 .117 .552 .035
	Wat3 .911 .120 .492 .035
	Wat4 .802 .268 .246 .44 .035
	Wat5 .749 .294 .392 .56 .035
	Wat6 .754 .11 .01 .16 .035
	Wat7 .750 .194 .168 .79 .035
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
	Barrerite
	Ori S, Mazzucato E, Vezzalini G
	American Mineralogist 94 (2009) 64-73
	Dehydration dynamics of barrerite: An in situ synchrotron XRPD study
	Locality: Kuiu Island, Alaska
	Note: BAR-A, T = 339 K
	_database_code_amcsd 0004773
	13.6336 18.2056 17.8445 90 90 90 Amma
	atom x y z occ Uiso
	NaC1 .25 0 .045 .135 .071
	KC1 .25 0 .045 .054 .071
	MgC1 .25 0 .045 .005 .071
	CaC1 .25 0 .045 .034 .071
	NaC1P .25 0 .463 .296 .071
	KC1P .25 0 .463 .119 .071
	MgC1P .25 0 .463 .010 .071
	CaC1P .25 0 .463 .074 .071
	NaC2 .048 .064 .004 .121 .071
	KC2 .048 .064 .004 .049 .071
	MgC2 .048 .064 .004 .004 .071
	CaC2 .048 .064 .004 .030 .071
	NaC2P .100 .078 .431 .193 .071
	KC2P .100 .078 .431 .078 .071
	MgC2P .100 .078 .431 .007 .071
	CaC2P .100 .078 .431 .048 .071
	NaC3 .193 0 .289 .147 .071
	KC3 .193 0 .289 .058 .071
	MgC3 .193 0 .289 .005 .071
	CaC3 .193 0 .289 .036 .071
	SiT1 .1354 .3066 .1264 .769 .046
	AlT1 .1354 .3066 .1264 .231 .046
	SiT1P .1340 .3092 .3748 .769 .046
	AlT1P .1340 .3092 .3748 .231 .046
	SiT3 .0512 .4112 .2459 .769 .046
	AlT3 .0512 .4112 .2459 .231 .046
	SiT4 .1400 .1845 .2490 .769 .046
	AlT4 .1400 .1845 .2490 .231 .046
	SiT5 0 .2388 0 .769 .046
	AlT5 0 .2388 0 .231 .046
	O1 .0722 .2921 .0486 .054
	O1P .0716 .3181 .4537 .054
	O3 .122 .2308 .1719 .054
	O3P .126 .2363 .3229 .054
	O4 .102 .3825 .1686 .054
	O4P .103 .3753 .3195 .054
	O7 .25 .310 .097 .054
	O7P .25 .3226 .396 .054
	O8 .0657 .1138 .246 .054
	O9 .0525 .5 .240 .054
	O10 .25 .1495 .254 .054
	Wat1P .152 .155 .445 .40 .071
	Wat2 .25 .124 .065 .73 .071
	Wat2P .25 .129 .447 .36 .071
	Wat3 .164 0 .164 .39 .071
	Wat3P .25 0 .336 .40 .071
	Wat4 .211 0 .056 .40 .071
	Wat4P .071 0 .401 .25 .071
	Wat5 .152 .5 .061 .31 .071
	Wat6 .046 .5 -.035 .58 .071
	Wat6P .402 .5 .426 .21 .071
	Wat8 .25 .5 .096 .62 .071
	Wat8P .25 .5 .380 .52 .071
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	Barrerite
	Ori S, Mazzucato E, Vezzalini G
	American Mineralogist 94 (2009) 64-73
	Dehydration dynamics of barrerite: An in situ synchrotron XRPD study
	Locality: Kuiu Island, Alaska
	Note: BAR-A, T = 482 K
	_database_code_amcsd 0004774
	13.6744 17.8937 17.5723 90 90 90 Amma
	atom x y z occ Uiso
	NaC1 .25 0 -.032 .227 .123
	KC1 .25 0 -.032 .091 .123
	MgC1 .25 0 -.032 .008 .123
	CaC1 .25 0 -.032 .057 .123
	NaC1P .25 0 .450 .108 .123
	KC1P .25 0 .450 .044 .123
	MgC1P .25 0 .450 .004 .123
	CaC1P .25 0 .450 .027 .123
	NaC2 .074 -.010 .088 .108 .123
	KC2 .074 -.010 .088 .044 .123
	MgC2 .074 -.010 .088 .004 .123
	CaC2 .074 -.010 .088 .027 .123
	NaC2P .083 .105 .468 .201 .123
	KC2P .083 .105 .468 .081 .123
	MgC2P .083 .105 .468 .007 .123
	CaC2P .083 .105 .468 .050 .123
	NaC3 .209 0 .233 .124 .123
	KC3 .209 0 .233 .050 .123
	MgC3 .209 0 .233 .004 .123
	CaC3 .209 0 .233 .031 .123
	NaCA 0 .039 0 .077 .123
	KCA 0 .039 0 .031 .123
	MgCA 0 .039 0 .003 .123
	CaCA 0 .039 0 .019 .123
	AlT1 .1362 .2920 .1230 .231 .049
	SiT1 .1362 .2920 .1230 .769 .049
	AlT1P .1335 .3248 .3696 .231 .049
	SiT1P .1335 .3248 .3696 .769 .049
	AlT3 .0472 .4095 .2298 .231 .049
	SiT3 .0472 .4095 .2298 .769 .049
	AlT4 .1403 .1867 .2643 .231 .049
	SiT4 .1403 .1867 .2643 .769 .049
	AlT5 0 .2156 0 .231 .049
	SiT5 0 .2156 0 .769 .049
	O1 .0723 .2733 .0462 .065
	O1P .0690 .3396 .4477 .065
	O3 .122 .2316 .1876 .065
	O3P .132 .2419 .3351 .065
	O4 .1083 .3735 .1577 .065
	O4P .1013 .3865 .3092 .065
	O7 .25 .3081 .0924 .065
	O7P .25 .3422 .3884 .065
	O8 .0685 .1178 .2719 .065
	O9 .056 .5 .2173 .065
	O10 .25 .1453 .2642 .065
	Wat2 .25 .126 .095 .35 .123
	Wat2P .25 .139 .432 .27 .123
	Wat4P .291 0 .310 .32 .123
	Wat5 .094 .5 .074 .80 .123
	Wat8 .25 .5 .098 .35 .123
	Wat8P .25 .5 .340 .93 .123
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	Barrerite
	Ori S, Mazzucato E, Vezzalini G
	American Mineralogist 94 (2009) 64-73
	Dehydration dynamics of barrerite: An in situ synchrotron XRPD study
	Locality: Kuiu Island, Alaska
	Note: BAR-B, T = 637 K
	_database_code_amcsd 0004775
	13.5502 17.1487 16.0919 90 90 90 Amma
	atom x y z occ Uiso
	NaC1 .549 .5 -.507 .210 .051
	KC1 .549 .5 -.507 .084 .051
	MgC1 .549 .5 -.507 .007 .051
	CaC1 .549 .5 -.507 .053 .051
	NaC2 .5 .525 -.5 .159 .051
	KC2 .5 .525 -.5 .064 .051
	MgC2 .5 .525 -.5 .006 .051
	CaC2 .5 .525 -.5 .040 .051
	NaC3 .539 .5 06 .311 .051
	KC3 .539 .5 06 .125 .051
	MgC3 .539 .5 06 .011 .051
	CaC3 .539 .5 06 .078 .051
	NaC4 .75 0 -.281 .383 .051
	KC4 .75 0 -.281 .154 .051
	MgC4 .75 0 -.281 .014 .051
	CaC4 .75 0 -.281 .096 .051
	NaC5 .634 .573 -.142 .058 .051
	KC5 .634 .573 -.142 .023 .051
	MgC5 .634 .573 -.142 .002 .051
	CaC5 .634 .573 -.142 .015 .051
	SiT1 .6480 .7823 -.1152 .338 .074
	AlT1 .6480 .7823 -.1152 .102 .074
	SiT1P .6384 .8604 -.3621 .769 .074
	AlT1P .6384 .8604 -.3621 .231 .074
	SiT3 .5391 .9095 -.1990 .769 .074
	AlT3 .5391 .9095 -.1990 .231 .074
	SiT4 .6484 .6926 -.2885 .400 .074
	AlT4 .6484 .6926 -.2885 .120 .074
	SiT5 .5 .8228 -.5 .769 .074
	AlT5 .5 .8228 -.5 .231 .074
	SiT1D .6330 .8179 -.0437 .431 .074
	AlT1D .6330 .8179 -.0437 .129 .074
	SiT4D .6540 .6730 -.3550 .369 .074
	AlT4D .6540 .6730 -.3550 .111 .074
	O1 .5666 .7382 -.0552 .097
	O1P .5597 .8802 -.4367 .097
	O3 .6720 .7377 -.2022 .48 .097
	O3P .6286 .7657 -.3516 .097
	O4 .5974 .8685 -.1241 .097
	O4P .6140 .9060 -.2758 .097
	O7 .75 .8020 -.0635 .097
	O7P .75 .8968 -.3788 .097
	O8 .5746 .6184 -.3069 .097
	O9 .5393 0 -.1810 .097
	O10 .75 .6425 -.3022 .097
	OD .6553 .6483 -.4520 .50 .077
	Wat1 .75 0 -.143 .23 .051
	Wat2 .630 .5 -.206 .24 .051
	Wat3 .622 .530 -.487 .14 .051
	Wat4 .675 .5 -.102 .33 .051
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	Chabazite-Mg
	Montagna G, Bigi S, Konya P, Szakall S, Vezzalini G
	American Mineralogist 95 (2010) 939-945
	Chabazite-Mg: A new natural zeolite of the chabazite series
	Locality: basalts of Praga Hill, Veszprem County, West Hungary
	_database_code_amcsd 0005050
	9.3433 9.3433 9.3433 94.894 94.894 94.894 R-3m
	atom x y z occ Uiso
	MgC3a .425 .350 .425 .11 .085
	KC2 .2380 .2380 .2380 .26 .047
	CaC4 .5843 .5843 .221 .058 .041
	SiT .10679 .33406 .87926 .74 .0148
	AlT .10679 .33406 .87926 .26 .0148
	O1 .2583 -.2583 0 .0441
	O2 .1544 -.1544 .5 .0321
	O3 .2560 .2560 .8998 .0405
	O4 .0313 .0313 .3312 .0346
	Wat1 0 .5 .5 .48 .13
	Wat2 .258 .258 .524 .24 .16
	Wat3 .151 .419 .511 .29 .19
	Wat4 .375 -.375 .5 .34 .20
	Wat6a .289 .289 .232 .21 .072
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	Boggsite
	Arletti R, Quartieri S, Vezzalini G
	American Mineralogist 95 (2010) 1247-1256
	Elastic behavior of zeolite boggsite in silicon oil and aqueous medium:
	A case of high-pressure-induced over hydration,
	Sample: P = 0.0 GPa
	Note: assignment of site chemistry does not match chemical analysis
	_database_code_amcsd 0017092
	20.3266 23.8760 12.8252 90 90 90 Imma
	atom x y z occ Uiso
	Si1 .1889 .1870 .670 .0163
	Si2 .1873 .0257 .329 .0163
	Si3 .0751 .1839 .833 .0163
	Si4 .0772 .0175 .165 .0163
	Si5 .2226 .0819 .541 .0163
	Si6 .1231 .0848 .967 .0163
	O1 .195 .25 .614 .023
	O2 .120 .173 .733 .023
	O3 .199 .146 .566 .023
	O4 .183 .072 .423 .023
	O5 .115 .035 .274 .023
	O6 .092 .25 .872 .023
	O7 .00 .175 .794 .023
	O8 .00 .027 .196 .023
	O9 .186 .0391 .619 .023
	O10 .106 .1515 .942 .023
	O11 .086 .074 .085 .023
	O12 .199 .0732 .967 .023
	O13 .099 .037 .881 .023
	O14 .25 .173 .75 .023
	O15 .25 -.027 .75 .023
	CaX1 .00 .178 .132 .48 .154
	OX2 .181 .1653 .235 1.29 .154
	OX3 .204 .25 .090 .56 .154
	OX4 .099 .183 .463 .65 .154
	OX5 .00 .25 .555 .81 .154
	OX6 .00 -.043 .417 1.11 .154
	CaX7 .063 .153 .376 .40 .154
	OX8 .035 .135 .585 .72 .154
	CaX9 .062 .25 .286 .46 .154
	OX10 .125 .25 .070 1.07 .154
	OX11 .202 .25 .369 .73 .154
	OX12 .219 .25 .243 .45 .154
	OX13 .00 .060 .408 .98 .154
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	Boggsite
	Arletti R, Quartieri S, Vezzalini G
	American Mineralogist 95 (2010) 1247-1256
	Elastic behavior of zeolite boggsite in silicon oil and aqueous medium:
	A case of high-pressure-induced over hydration,
	Sample: P = 2.5 GPa
	Note: assignment of site chemistry does not match chemical analysis
	_database_code_amcsd 0017093
	20.082 23.613 12.709 90 90 90 Imma
	atom x y z occ Uiso
	Si1 .1907 .1862 .6680 .015
	Si2 .1855 .0256 .322 .015
	Si3 .0781 .1860 .833 .015
	Si4 .078 .0198 .164 .015
	Si5 .2217 .0784 .543 .015
	Si6 .1259 .0843 .963 .015
	O1 .180 .25 .614 .027
	O2 .123 .168 .729 .027
	O3 .201 .144 .569 .027
	O4 .201 .068 .418 .027
	O5 .110 .037 .274 .027
	O6 .100 .25 .857 .027
	O7 .00 .173 .833 .027
	O8 .00 .029 .197 .027
	O9 .187 .032 .614 .027
	O10 .093 .146 .936 .027
	O11 .080 .065 .063 .027
	O12 .203 .085 .976 .027
	O13 .103 .044 .866 .027
	O14 .25 .183 .75 .027
	O15 .25 -.023 .75 .027
	CaX1 .00 .186 .172 .51 .164
	OX2 .164 .157 .206 1.30 .164
	OX3 .229 .25 .058 .87 .164
	OX4 .092 .136 .421 .70 .164
	OX5 .00 .25 .577 1.65 .164
	OX6 .00 -.040 .449 1.19 .164
	CaX7 .089 .171 .417 .40 .164
	OX8 .044 .110 .621 .77 .164
	CaX9 .046 .25 .291 .42 .164
	OX10 .117 .25 .061 .99 .164
	OX11 .193 .25 .340 .97 .164
	OX12 .190 .25 .213 .81 .164
	OX13 .0 .088 .352 .91 .164
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
	Boggsite
	Arletti R, Quartieri S, Vezzalini G
	American Mineralogist 95 (2010) 1247-1256
	Elastic behavior of zeolite boggsite in silicon oil and aqueous medium:
	A case of high-pressure-induced over hydration,
	Sample: P = 3.6 GPa
	Note: assignment of site chemistry does not match chemical analysis
	_database_code_amcsd 0017094
	19.949 23.445 12.607 90 90 90 Imma
	atom x y z occ Uiso
	Si1 .1891 .1880 .679 .015
	Si2 .1883 .0230 .318 .015
	Si3 .0788 .1821 .838 .015
	Si4 .0802 .0183 .165 .015
	Si5 .2179 .0783 .542 .015
	Si6 .1260 .0818 .965 .015
	O1 .187 .25 .613 .051
	O2 .118 .173 .726 .051
	O3 .209 .145 .573 .051
	O4 .204 .067 .417 .051
	O5 .112 .040 .277 .051
	O6 .092 .25 .858 .051
	O7 0 .172 .812 .051
	O8 0 .027 .172 .051
	O9 .175 .037 .617 .051
	O10 .093 .142 .942 .051
	O11 .088 .071 .078 .051
	O12 .204 .073 .974 .051
	O13 .106 .046 .863 .051
	O14 .25 .1927 .75 .051
	O15 .25 -.0462 .75 .051
	CaX1 0 .198 .119 .51 .165
	OX2 .173 .157 .195 1.16 .165
	OX3 .306 .25 .115 .88 .165
	OX4 .098 .155 .315 .77 .165
	OX5 0 .25 .559 1.61 .165
	OX6 0 -.042 .441 1.19 .165
	CaX7 .079 .163 .443 .37 .165
	OX8 .0504 .111 .605 .85 .165
	CaX9 .012 .25 .319 .45 .165
	OX10 .175 .25 .006 1.19 .165
	OX11 .123 .25 .232 1.01 .165
	OX12 .222 .25 .157 .86 .165
	OX13 0 .057 .359 .90 .165
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	Boggsite
	Arletti R, Quartieri S, Vezzalini G
	American Mineralogist 95 (2010) 1247-1256
	Elastic behavior of zeolite boggsite in silicon oil and aqueous medium:
	A case of high-pressure-induced over hydration,
	Sample: P = 0.0 GPa on release of pressure
	Note: assignment of site chemistry does not match chemical analysis
	_database_code_amcsd 0017095
	20.326 23.883 12.836 90 90 90 Imma
	atom x y z occ Uiso
	Si1 .1889 .1853 .669 .015
	Si2 .1852 .0209 .324 .015
	Si3 .0774 .1854 .834 .015
	Si4 .0780 .0236 .167 .015
	Si5 .2237 .0796 .532 .015
	Si6 .1211 .0826 .960 .015
	O1 .185 .25 .628 .012
	O2 .117 .173 .727 .012
	O3 .202 .141 .576 .012
	O4 .189 .071 .415 .012
	O5 .114 .044 .275 .012
	O6 .084 .25 .867 .012
	O7 .00 .173 .801 .012
	O8 .00 .028 .196 .012
	O9 .191 .0404 .618 .012
	O10 .098 .1450 .931 .012
	O11 .092 .0678 .074 .012
	O12 .1988 .0812 .968 .012
	O13 .103 .0375 .874 .012
	O14 .25 .185 .75 .012
	O15 .25 -.0266 .75 .012
	CaX1 .00 .180 .144 .53 .174
	OX2 .186 .164 .221 1.15 .174
	OX3 .198 .25 .077 .59 .174
	OX4 .130 .177 .495 .53 .174
	OX5 .00 .25 .520 .96 .174
	OX6 .00 -.044 .409 1.11 .174
	CaX7 .079 .142 .379 .44 .174
	OX8 .050 .141 .577 .71 .174
	CaX9 .064 .25 .294 .41 .174
	OX10 .107 .25 .075 .91 .174
	OX11 .179 .25 .351 .96 .174
	OX12 .218 .25 .157 .44 .174
	OX13 .00 .079 .407 .90 .174
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	Dachiardite-Ca
	Quartieri S, Vezzalini G, Alberti A
	European Journal of Mineralogy 2 (1990) 187-193
	Dachiardite from Hokiya-dake: evidence of a new topology
	Locality: Hokiya-dake, Japan
	_database_code_amcsd 0006381
	18.625 7.508 10.247 90 108.056 90 C2/m
	atom x y z occ Biso
	CaC1 .4902 .2391 .1335 .32 7.5
	KC2 .5422 0 .5361 .15 6.3
	NaC2 .5422 0 .5361 .09 6.3
	KC3 1/2 .252 0 .08 6.6
	NaC3 1/2 .252 0 .06 6.6
	SiT1 .2872 .2063 .1578 .87 1.5
	AlT1 .2872 .2063 .1578 .05 1.5
	SiT1M .288 .266 .168 .07 2.2
	SiT2 .1917 .2959 .3554 .90 1.9
	AlT2 .1917 .2959 .3554 .02 1.9
	SiT2M .188 .230 .356 .08 2.2
	SiT3 .0964 0 .6995 .64 1.0
	AlT3 .0964 0 .6995 .28 1.0
	SiT3M .089 1/2 .691 .05 2.2
	AlT3M .089 1/2 .691 .03 2.2
	SiT4 .0809 0 .3792 .61 1.0
	AlT4 .0809 0 .3792 .31 1.0
	SiT4M .078 1/2 .372 .05 2.2
	AlT4M .078 1/2 .372 .03 2.2
	O1 .3636 .3204 .2181 .92 3.4
	O1M .376 .152 .226 .08 4.3
	O2 .1152 .1791 .3284 .92 2.9
	O2M .113 .314 .316 .08 4.3
	O3 .2264 .2563 .2338 5.8
	O4 .0991 0 .5440 .92 3.4
	O4M .083 1/2 .528 .08 4.3
	O5 .1669 1/2 .3461 .92 3.4
	O5M .171 0 .356 .08 4.3
	O6 .3107 0 .1769 .92 3.3
	O6M .326 1/2 .199 .08 4.3
	O7 1/4 1/4 0 6.3
	O8 1/4 1/4 1/2 6.2
	O9 .0102 0 .7079 .92 1.9
	O9M .004 1/2 .611 .08 4.3
	Wat1 .4908 0 .2565 .92 6.3
	Wat2 .0835 0 .0336 .54 5.0
	Wat3 .0689 .1334 .0217 .23 8.1
	Wat4 .0743 .6055 .0262 .26 5.6
	Wat5 .0919 1/2 .0324 .48 7.1
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
	Calcioancylite-(Nd)
	Orlandi P, Pasero M, Vezzalini G
	European Journal of Mineralogy 2 (1990) 413-418
	Calcio-ancylite-(Nd), a new REE-carbonate from Baveno, Italy
	Locality: Baveno, Italy
	_database_code_amcsd 0006385
	4.976 8.468 7.212 90.04 90 90 *Pm
	.25 0 0
	atom x y z occ Uiso
	NdM1 1/4 .3399 .3524 .225 .0132
	CeM1 1/4 .3399 .3524 .160 .0132
	SmM1 1/4 .3399 .3524 .083 .0132
	GdM1 1/4 .3399 .3524 .070 .0132
	YM1 1/4 .3399 .3524 .065 .0132
	PrM1 1/4 .3399 .3524 .037 .0132
	LaM1 1/4 .3399 .3524 .035 .0132
	DyM1 1/4 .3399 .3524 .017 .0132
	TmM1 1/4 .3399 .3524 .007 .0132
	CaM1 1/4 .3399 .3524 .300 .0132
	NdM2 1/4 .1677 .8517 .130 .0149
	CeM2 1/4 .1677 .8517 .092 .0149
	SmM2 1/4 .1677 .8517 .048 .0149
	GdM2 1/4 .1677 .8517 .040 .0149
	YM2 1/4 .1677 .8517 .037 .0149
	PrM2 1/4 .1677 .8517 .022 .0149
	LaM2 1/4 .1677 .8517 .020 .0149
	DyM2 1/4 .1677 .8517 .010 .0149
	TmM2 1/4 .1677 .8517 .004 .0149
	CaM2 1/4 .1677 .8517 .596 .0149
	NdM3 3/4 .6609 .6448 .203 .0102
	CeM3 3/4 .6609 .6448 .145 .0102
	SmM3 3/4 .6609 .6448 .075 .0102
	GdM3 3/4 .6609 .6448 .063 .0102
	YM3 3/4 .6609 .6448 .059 .0102
	PrM3 3/4 .6609 .6448 .034 .0102
	LaM3 3/4 .6609 .6448 .032 .0102
	DyM3 3/4 .6609 .6448 .016 .0102
	TmM3 3/4 .6609 .6448 .007 .0102
	CaM3 3/4 .6609 .6448 .367 .0102
	NdM4 3/4 .8440 .1445 .321 .0082
	CeM4 3/4 .8440 .1445 .229 .0082
	SmM4 3/4 .8440 .1445 .118 .0082
	GdM4 3/4 .8440 .1445 .100 .0082
	YM4 3/4 .8440 .1445 .093 .0082
	PrM4 3/4 .8440 .1445 .054 .0082
	LaM4 3/4 .8440 .1445 .050 .0082
	DyM4 3/4 .8440 .1445 .025 .0082
	TmM4 3/4 .8440 .1445 .011 .0082
	C1 3/4 .191 .177 .017
	C2 3/4 .312 .699 .017
	C3 1/4 .817 .805 .007
	C4 1/4 .687 .314 .011
	O11 3/4 .325 .272 .012
	O12 3/4 .194 .790 .008
	O13 1/4 .695 .705 .033
	O14 1/4 .831 .241 .028
	O21 .529 .125 .143 .015
	O22 .520 .383 .649 .018
	O23 .480 .885 .847 .023
	O24 .473 .622 .353 .021
	O31 1/4 .412 .036 .023
	O32 1/4 .082 .526 .016
	O33 3/4 .590 .981 .020
	O34 3/4 .899 .463 .015
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
	Brewsterite-Ba
	Cabella R, Lucchetti G, Palenzona A, Quartieri S, Vezzalini G
	European Journal of Mineralogy 5 (1993) 353-360
	First occurrence of a Ba-dominant brewsterite: structural features
	_database_code_amcsd 0006480
	6.790 17.581 7.735 90 94.50 90 P2_1/m
	atom x y z occ Biso
	BaBA1 .2458 1/4 .1734 .82 1.3
	NaBA1 .2458 1/4 .1734 .035 1.3
	KBA1 .2458 1/4 .1734 .02 1.3
	MgBA1 .2458 1/4 .1734 .04 1.3
	BaBA2 .264 1/4 .043 .04 4.0
	BaBA3 .211 1/4 .297 .04 4.0
	AlTA .3215 .0803 .8230 .35 1.1
	SiTA .3215 .0803 .8230 .65 1.1
	AlTB .4070 .0566 .2116 .35 1.1
	SiTB .4070 .0566 .2116 .65 1.1
	AlTC .5534 .1581 .5349 .35 .9
	SiTC .5534 .1581 .5349 .65 .9
	SiTD .9067 .0526 .6412 1.1
	O1 .3537 .1034 .028 1.3
	O2 .426 .1222 .360 1.8
	O3 .784 .1212 .547 1.7
	O4 .446 .1403 .714 1.8
	O5 .081 .0911 .765 2.5
	O6 .227 .9969 .240 2.6
	O7 .383 .9920 .795 1.7
	O8 0 0 1/2 2.8
	O9 .564 1/4 .501 2.1
	Wat1 .051 1/4 .469 .96 3.2
	Wat2 .920 .1414 .142 5.0
	Wat3 .607 1/4 .022 .96 4.1
	Wat4 .060 1/4 .854 .96 3.5
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	Quadridavyne
	Bonaccorsi E, Merlino S, Orlandi P, Pasero M, Vezzalini G
	European Journal of Mineralogy 6 (1994) 481-487
	Quadridavyne, [(Na,K)6Cl2][Ca2Cl2][Si6Al6O24], a new feldspathoid
	mineral from Vesuvius area
	Note: Cl1 y-coordinate altered
	Locality: Vesuvius, Italy
	_database_code_amcsd 0006545
	25.771 25.771 5.371 90 90 120 P6_3/m
	atom x y z occ
	Naint(ab) .052 .106 1/4 .28
	Kint(ab) .052 .106 1/4 .10
	Namid(ab) .068 .139 1/4 .24
	Kmid(ab) .068 .139 1/4 .12
	Naext(ab) .091 .182 1/4 .20
	Kext(ab) .091 .182 1/4 .06
	Naint(c1) .391 .439 1/4
	Naint(c2) .587 .414 1/4
	Kext(c) .591 .683 1/4
	Si1 .1615 .2049 3/4
	Si2 .2921 .4597 3/4
	Si3 .041 .335 3/4
	Si4 .2082 .5408 1/4
	Al1 .0345 .2082 3/4
	Al2 .299 .333 3/4
	Al3 .168 .464 3/4
	Al4 .209 .6692 1/4
	O1 .105 .215 3/4
	O2 .060 .2844 3/4
	O3 .172 .002 .02
	O5 .294 .399 3/4
	O6 .211 .273 3/4
	O7 .667 -.005 .021
	O8 .669 .506 .508
	O9 .106 .398 3/4
	O10 .223 .445 3/4
	O11 .174 .511 .993
	O13 .220 .608 1/4
	O14 .276 .553 1/4
	Ca1 2/3 1/3 3/4
	Cl1 2/3 1/3 1/4
	Ca2 .334 .169 1/4
	Cl2 .3130 .1561 3/4
	Cl(a) -.018 .024 1/4 1/6
	Cl(b) .029 .047 1/4 1/6
	Cl(c) .529 .547 1/4
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
	Gottardiite
	Alberti A, Vezzalini G, Galli E, Quartieri S
	European Journal of Mineralogy 8 (1996) 69-75
	The crystal structure of gottardiite, a new natural zeolite
	Note: occupancies altered to match chemical formula
	_database_code_amcsd 0006612
	13.698 25.213 22.660 90 90 90 Cmca
	atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	SiT1 0 .0804 .1973 .861 1.18 .013 .013 .019 0 0 -.002
	AlT1 0 .0804 .1973 .138 1.18 .013 .013 .019 0 0 -.002
	FeT1 0 .0804 .1973 .001 1.18 .013 .013 .019 0 0 -.002
	SiT2 0 .1784 .2828 .861 1.47 .014 .021 .021 0 0 -.004
	AlT2 0 .1784 .2828 .138 1.47 .014 .021 .021 0 0 -.004
	FeT2 0 .1784 .2828 .001 1.47 .014 .021 .021 0 0 -.004
	SiT3 0 .2884 .2204 .861 1.39 .021 .015 .017 0 0 -.003
	AlT3 0 .2884 .2204 .138 1.39 .021 .015 .017 0 0 -.003
	FeT3 0 .2884 .2204 .001 1.39 .021 .015 .017 0 0 -.003
	SiT4 0 .3841 .3023 .861 1.34 .012 .022 .017 0 0 -.007
	AlT4 0 .3841 .3023 .138 1.34 .012 .022 .017 0 0 -.007
	FeT4 0 .3841 .3023 .001 1.34 .012 .022 .017 0 0 -.007
	SiT5 0 .4818 .2235 .861 1.68 .030 .019 .015 0 0 .004
	AlT5 0 .4818 .2235 .138 1.68 .030 .019 .015 0 0 .004
	FeT5 0 .4818 .2235 .001 1.68 .030 .019 .015 0 0 .004
	SiT6 .2102 .0023 .3160 .861 1.95 .020 .030 .024 .004 -.005 .001
	AlT6 .2102 .0023 .3160 .138 1.95 .020 .030 .024 .004 -.005 .001
	FeT6 .2102 .0023 .3160 .001 1.95 .020 .030 .024 .004 -.005 .001
	SiT7 .1934 .0978 .1253 .861 1.34 .014 .019 .018 -.005 .006 -.003
	AlT7 .1934 .0978 .1253 .138 1.34 .014 .019 .018 -.005 .006 -.003
	FeT7 .1934 .0978 .1253 .001 1.34 .014 .019 .018 -.005 .006 -.003
	SiT8 .2122 .1948 .3174 .861 1.11 .011 .014 .017 .001 -.004 .001
	AlT8 .2122 .1948 .3174 .138 1.11 .011 .014 .017 .001 -.004 .001
	FeT8 .2122 .1948 .3174 .001 1.11 .011 .014 .017 .001 -.004 .001
	SiT9 .2143 .3111 .1846 .861 1.32 .018 .012 .020 -.005 .001 .001
	AlT9 .2143 .3111 .1846 .138 1.32 .018 .012 .020 -.005 .001 .001
	FeT9 .2143 .3111 .1846 .001 1.32 .018 .012 .020 -.005 .001 .001
	SiT10 .1873 .4049 .3752 .861 1.18 .015 .015 .015 .002 .004 -.004
	AlT10 .1873 .4049 .3752 .138 1.18 .015 .015 .015 .002 .004 -.004
	FeT10 .1873 .4049 .3752 .001 1.18 .015 .015 .015 .002 .004 -.004
	SiT11 .1151 .0634 .0009 .861 1.53 .025 .019 .014 -.007 .005 -.004
	AlT11 .1151 .0634 .0009 .138 1.53 .025 .019 .014 -.007 .005 -.004
	FeT11 .1151 .0634 .0009 .001 1.53 .025 .019 .014 -.007 .005 -.004
	O1 0 .0208 .2214 3.92 .088 .015 .046 0 0 -.004
	O2 .0969 .0897 .1594 .84 .025 .084 .113 .002 .049 .009
	O3 0 .1213 .2499 .76 .075 .041 .027 0 0 -.015
	O4 .0955 .1833 .3238 .63 .020 .059 .021 -.001 .001 -.012
	O5 0 .2249 .2361 3.11 .046 .012 .060 0 0 -.014
	O6 .0928 .3040 .1810 2.87 .017 .054 .038 -.008 .007 .010
	O7 0 .3225 .2802 2.53 .055 .017 .024 0 0 -.003
	O8 .0840 .3950 .3443 6.37 .050 .110 .082 -.001 -.044 -.041
	O9 0 .4225 .2462 6.55 .205 .008 .036 0 0 -.016
	O10 .0928 .4920 .1818 3.74 .033 .076 .033 .003 .010 -.006
	O11 .2280 .1576 .1350 2.66 .027 .038 .036 -.002 -.007 -.006
	O12 .2242 .0598 .3504 3.61 .042 .027 .068 -.003 -.009 .005
	O13 .2381 .4586 .3559 5.90 .094 .032 .098 -.012 .073 .014
	O14 .1754 .0893 .0555 3.00 .026 .079 .009 -.010 -.001 -.014
	O15 .2329 .2564 .3357 3.16 .055 .028 .037 -.015 .003 -.004
	O16 .25 .1829 .25 2.03 .037 .031 .009 0 .004 0
	O17 .2381 .3553 .1332 2.79 .049 .036 .021 -.031 -.016 .012
	O18 .25 .3290 .25 1.89 .029 .017 .026 0 .003 0
	O19 .25 .0050 .25 5.66 .033 .146 .036 0 .003 0
	O20 0 .0807 .0048 2.82 .036 .029 .042 0 0 -.003
	O21 .1276 0 0 3.26 .033 .021 .070 0 0 -.005
	O22 .1627 .4084 .4406 5.34 .102 .058 .043 .050 .025 .004
	NaX1 0 .386 .999 .0186 1.7
	KX1 0 .386 .999 .0013 1.7
	MgX1 0 .386 .999 .023 1.7
	CaX1 0 .386 .999 .0356 1.7
	WatX1 0 .386 .999 .6824 1.7
	NaX2 0 .183 .430 .0186 4.6
	KX2 0 .183 .430 .0013 4.6
	MgX2 0 .183 .430 .023 4.6
	CaX2 0 .183 .430 .0356 4.6
	WatX2 0 .183 .430 .6824 4.6
	NaX3 0 .263 .996 .0186 3.9
	KX3 0 .263 .996 .0013 3.9
	MgX3 0 .263 .996 .023 3.9
	CaX3 0 .263 .996 .0356 3.9
	WatX3 0 .263 .996 .6824 3.9
	NaX4 0 .081 .404 .0186 6.5
	KX4 0 .081 .404 .0013 6.5
	MgX4 0 .081 .404 .023 6.5
	CaX4 0 .081 .404 .0356 6.5
	WatX4 0 .081 .404 .6824 6.5
	NaX5 .067 .281 .421 .0186 9.1
	KX5 .067 .281 .421 .0013 9.1
	MgX5 .067 .281 .421 .023 9.1
	CaX5 .067 .281 .421 .0356 9.1
	WatX5 .067 .281 .421 .6824 9.1
	NaX6 .121 .458 .019 .0186 3.9
	KX6 .121 .458 .019 .0013 3.9
	MgX6 .121 .458 .019 .023 3.9
	CaX6 .121 .458 .019 .0356 3.9
	WatX6 .121 .458 .019 .6824 3.9
	NaX7 0 .192 .071 .0186 11.0
	KX7 0 .192 .071 .0013 11.0
	MgX7 0 .192 .071 .023 11.0
	CaX7 0 .192 .071 .0356 11.0
	WatX7 0 .192 .071 .6824 11.0
	NaX8 .151 .349 .994 .0186 6.6
	KX8 .151 .349 .994 .0013 6.6
	MgX8 .151 .349 .994 .023 6.6
	CaX8 .151 .349 .994 .0356 6.6
	WatX8 .151 .349 .994 .6824 6.6
	NaX9 0 .390 .103 .0186 8.9
	KX9 0 .390 .103 .0013 8.9
	MgX9 0 .390 .103 .023 8.9
	CaX9 0 .390 .103 .0356 8.9
	WatX9 0 .390 .103 .6824 8.9
	NaX10 .120 .268 .558 .0186 9.4
	KX10 .120 .268 .558 .0013 9.4
	MgX10 .120 .268 .558 .023 9.4
	CaX10 .120 .268 .558 .0356 9.4
	WatX10 .120 .268 .558 .6824 9.4
	NaX11 .193 .271 .473 .0186 12.3
	KX11 .193 .271 .473 .0013 12.3
	MgX11 .193 .271 .473 .023 12.3
	CaX11 .193 .271 .473 .0356 12.3
	WatX11 .193 .271 .473 .6824 12.3
	NaX12 0 .301 .064 .0186 8.9
	KX12 0 .301 .064 .0013 8.9
	MgX12 0 .301 .064 .023 8.9
	CaX12 0 .301 .064 .0356 8.9
	WatX12 0 .301 .064 .6824 8.9
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	Katoite
	Ferro O, Galli E, Papp G, Quartieri S, Szakall S, Vezzalini G
	European Journal of Mineralogy 15 (2003) 419-426
	A new occurrence of katoite and re-examination of the hydrogrossular group
	Sample: Unsplit-O model, T = 200 K
	_database_code_amcsd 0006980
	12.270 12.270 12.270 90 90 90 Ia-3d
	atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	Ca 1/8 0 1/4 .972 .0094 .0108 .0087 .0087 0 0 .0023
	Al 0 0 0 .0137 .0137 .0137 .0137 -.0036 -.0036 -.0036
	Si 3/8 0 1/4 .364 .0063 .0059 .0065 .0065 0 0 0
	O .03237 .04982 .64450 .0219 .0298 .0173 .0187 -.0072 .0120 -.0073
	H .075 .061 .655 .636
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
	Katoite
	Ferro O, Galli E, Papp G, Quartieri S, Szakall S, Vezzalini G
	European Journal of Mineralogy 15 (2003) 419-426
	A new occurrence of katoite and re-examination of the hydrogrossular group
	Sample: Split-O model, T = 200 K
	_database_code_amcsd 0006981
	12.270 12.270 12.270 90 90 90 Ia-3d
	atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	Ca 1/8 0 1/4 .972 .0094 .0108 .0087 .0087 0 0 .0023
	Al 0 0 0 .0136 .0136 .0136 .0136 -.0037 -.0037 -.0037
	Si 3/8 0 1/4 .368 .0068 .0063 .0070 .0070 0 0 0
	O1 .0439 .0436 .6528 .37 .0084
	O2 .0250 .0537 .6393 .63 .0152
	H .081 .060 .656 .63 .0380
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	Stellerite
	Alberti A, Rinaldi R, Vezzalini G
	Physics and Chemistry of Minerals 2 (1978) 365-375
	Dynamics of dehydration in stilbite-type structures; stellerite phase B
	Sample: Stellerite phase B
	_database_code_amcsd 0007338
	13.62 17.16 16.68 90 90 90 Amma
	atom x y z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	SiT1 .1344 .3541 .1373 .779 .0015 .0050 .0035 -.0009 .0001 -.0004
	AlT1 .1344 .3541 .1373 .221 .0015 .0050 .0035 -.0009 .0001 -.0004
	SiT1P .1390 .2690 .3833 .7011 .0011 .0020 .0024 .0001 -.0002 -.0001
	AlT1P .1390 .2690 .3833 .1989 .0011 .0020 .0024 .0001 -.0002 -.0001
	SiT3 .0513 .4109 .3045 .779 .0020 .0023 .0039 -.0006 -.0002 .0002
	AlT3 .0513 .4109 .3045 .221 .0020 .0023 .0039 -.0006 -.0002 .0002
	SiT4 .1394 .1861 .2188 .7011 .0011 .0021 .0024 -.0002 .0001 -.0008
	AlT4 .1394 .1861 .2188 .1989 .0011 .0021 .0024 -.0002 .0001 -.0008
	SiT5 0 .3222 0 .779 .0018 .0023 .0031 0 .0004 0
	AlT5 0 .3222 0 .221 .0018 .0023 .0031 0 .0004 0
	SiT1PD .141 .302 .434 .0779 .0007
	AlT1PD .141 .302 .434 .0221 .0007
	SiT4D .149 .168 .174 .0779 .0002
	AlT4D .149 .168 .174 .0221 .0002
	O1 .0637 .3769 .0649 .0058 .0045 .0035 0 -.0033 -.0006
	O1P .0741 .2343 .4579 .0082 .0073 .0031 -.0028 .0012 .0012
	O3 .1284 .2569 .1525 .0054 .0037 .0041 .0009 .0005 .0005
	O3P .1226 .2156 .3063 .9 .0063 .0037 .0028 .0024 .0005 -.0015
	O4 .1080 .4006 .2173 .0058 .0037 .0029 -.0011 .0003 -.0017
	O4P .1030 .3567 .3693 .0064 .0044 .0082 .0028 -.0019 .0036
	O7 .25 .3829 .1119 .0076 .0065 .0043 0 0 -.0034
	O7P .25 .2675 .4149 .0009 .0085 .0071 0 0 .0014
	O8 .0678 .1194 .1998 .0026 .0046 .0086 -.0006 -.0009 .0009
	O9 .0519 .5 .3311 .0088 .0016 .0080 0 0 0
	O10 .25 .1552 .2063 .0001 .0062 .0094 0 0 -.0037
	OH1 .150 .130 .010 .10 .0005
	OH2 .160 .130 .080 .10 .0005
	CaC1 .25 .252 .050 .26908 .0007
	NaC1 .25 .252 .050 .03658 .0007
	KC1 .25 .252 .050 .00279 .0007
	MgC1 .25 .252 .050 .00155 .0007
	CaC2 .216 0 .188 .0868 .0008
	NaC2 .216 0 .188 .0118 .0008
	KC2 .216 0 .188 .0009 .0008
	MgC2 .216 0 .188 .0005 .0008
	CaC3 0 0 .5 .1302 .0011
	NaC3 0 0 .5 .0177 .0011
	KC3 0 0 .5 .00135 .0011
	MgC3 0 0 .5 .00075 .0011
	CaC4 .25 .5 .211 .54684 .0005
	NaC4 .25 .5 .211 .07434 .0005
	KC4 .25 .5 .211 .00567 .0005
	MgC4 .25 .5 .211 .00315 .0005
	Wat1 .25 0 .355 .24 .0003
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	Brewsterite-Sr
	Alberti A, Sacerdoti M, Quartieri S, Vezzalini G
	Physics and Chemistry of Minerals 26 (1999) 181-186
	Heating-induced phase transformation in zeolite brewsterite:
	new 4- and 5-coordinated (Si,Al) sites
	Sample: BR280R
	_database_code_amcsd 0008168
	6.676 16.547 7.543 90 94.41 90 P2_1/m
	atom x y z occ Uiso
	Sr1 .570 1/4 .066 .338 .127
	Sr2 .067 1/4 .568 .236 .098
	Sr3 .833 .132 .083 .118 .27
	Sr4 .055 1/4 .398 .160 .29
	Sr5 .716 1/4 -.054 .064 .10
	SiT1 .318 .0856 .829 .69 .055
	AlT11 .231 .160 .847 .31 .055
	SiT2 .407 .0650 .195 .80 .074
	AlT21 .227 .375 .207 .20 .074
	SiT3 .567 .1602 .540 .75 .074
	AlT3 .567 .1602 .540 .25 .074
	SiT4 .912 .0427 .652 .75 .066
	AlT4 .912 .0427 .652 .25 .066
	O1 .347 .118 .014 .12
	O2 .473 .139 .341 .15
	O3 .769 .115 .591 .17
	O4 .414 .145 .697 .13
	O5 .078 .085 .773 .15
	O6 .199 .019 .236 .13
	O7 .396 .996 .811 .80 .09
	Wat71 .103 1/4 .785 .91 .17
	Wat72 .231 1/4 .186 .67 .06
	O73 -.032 .154 .219 .20 .16
	O8 0 0 1/2 .09
	O9 .633 1/4 .525 .11
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	Amicite
	Alberti A, Vezzalini G
	Acta Crystallographica B35 (1979) 2866-2869
	The crystal structure of amicite, a zeolite
	Locality: basaltic rock at Howenegg in Hegau, southern West Germany
	_database_code_amcsd 0009695
	10.226 10.422 9.884 90 88.19 90 I2
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	K .3071 -.0040 .9692 2.09 .0060 .0046 .0046 .0017 -.0009 -.0010
	Na .4312 .2559 .6716 2.53 .0050 .0076 .0056 .0027 -.0006 -.0017
	Al1 .1546 .2491 .1546 0.43 .0009 .0011 .0011 .0000 .0000 .0002
	Al2 .1582 .0027 .6512 0.44 .0012 .0009 .0011 .0002 .0000 -.0002
	Si1 .1523 -.0133 .3261 0.46 .0012 .0010 .0011 .0004 .0001 .0001
	Si2 .1534 .2615 .8263 0.40 .0010 .0009 .0010 .0001 .0000 .0001
	O1 .0010 -.0471 .3037 1.21 .0014 .0033 .0041 -.0002 -.0001 -.0006
	O2 -.0030 .2956 .2047 1.14 .0016 .0037 .0030 .0004 .0001 -.0006
	O3 .2031 .1401 .7354 0.96 .0028 .0020 .0022 .0003 -.0003 -.0006
	O4 .1810 .0304 .4785 1.18 .0041 .0027 .0017 -.0005 -.0001 .0004
	O5 .1712 .2264 .9833 1.13 .0036 .0028 .0016 -.0001 .0000 .0005
	O6 .1989 .1018 .2263 1.00 .0034 .0011 .0028 .0005 .0002 .0006
	O7 .2620 .3610 .2184 1.09 .0031 .0017 .0031 -.0007 -.0003 .0002
	O8 .7558 .3812 .2177 0.73 .0020 .0015 .0018 .0008 -.0004 -.0002
	Wat1 .3435 .2507 .4539 2.65 .0064 .0074 .0054 -.0022 -.0020 .0010
	Wat2 .4779 .0682 .2179 2.76 .0044 .0054 .0103 -.0002 .0017 .0004
	Wat3 0 .3191 .5 2.70 .0069 .0058 .0070 0 -.0015 0
	Wat4 .5 .4729 .5 .53 2.35 .0084 .0041 .0046 0 -.0018 0
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	Wakefieldite-(Ce)
	Baudracco-Gritti C, Quartieri S, Vezzalini G, Permingeat F, Pillard F, Rinaldi R
	Bulletin de Mineralogie 110 (1987) 657-663
	Une wakefieldite-(Ce) non plombifere: nouvelles donnees sur
	l'espece minerale correspondant a l'orthovanadate de cerium
	_database_code_amcsd 0012088
	7.354 7.354 6.488 90 90 90 *I4_1/amd
	0 -.25 .125
	atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	Ce 0 .75 .125 .52 .74 .0112 .0112 .0059 0 0 0
	La 0 .75 .125 .18 .74 .0112 .0112 .0059 0 0 0
	Nd 0 .75 .125 .15 .74 .0112 .0112 .0059 0 0 0
	Y 0 .75 .125 .07 .74 .0112 .0112 .0059 0 0 0
	Pr 0 .75 .125 .05 .74 .0112 .0112 .0059 0 0 0
	Sm 0 .75 .125 .02 .74 .0112 .0112 .0059 0 0 0
	V 0 .75 .625 .92 .84 .0126 .0126 .0068 0 0 0
	As 0 .75 .625 .08 .84 .0126 .0126 .0068 0 0 0
	O 0 .0716 .2067 1.37 .024 .015 .013 0 0 -.001
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	Tschernichite
	Alberti A, Cruciani G, Galli E, Merlino S, Millini R, Quartieri S, Vezzalini G, Zanardi S
	Journal of Physical Chemistry B106 (2002) 10277-10284
	Crystal structure of tetragonal and monoclinic polytypes of tschernichite,
	the natural counterpart of synthetic zeolite beta
	Locality: Mt. Adamson, Northern Victoria Land, Antarctica
	Sample: large crystal, monoclinic
	_database_code_amcsd 0013153
	17.983 17.966 14.625 90 114.31 90 C2/c
	atom x y z occ Uiso
	Na1 .1438 .3576 .0005 .09 .039
	K1 .1438 .3576 .0005 .023 .039
	Mg1 .1438 .3576 .0005 .023 .039
	Ca1 .1438 .3576 .0005 .44 .039
	Ca2 .305 .521 -.004 .073 .03
	Ca3 .474 .696 .004 .079 .03
	Si1 .1708 .8334 .8880 .68 .014
	Al1 .1708 .8334 .8880 .32 .014
	Si2 .2070 .5437 .1145 .79 .017
	Al2 .2070 .5437 .1145 .21 .017
	Si3 .1924 .4185 .2512 .73 .016
	Al3 .1924 .4185 .2512 .27 .016
	Si4 .3940 .0186 .6136 .68 .018
	Al4 .3940 .0186 .6136 .32 .018
	Si5 .5201 .1450 .6140 .73 .018
	Al5 .5201 .1450 .6140 .27 .018
	Si6 .5 .2743 .75 .78 .014
	Al6 .5 .2743 .75 .22 .014
	Si7 .2971 .2926 .3892 .75 .014
	Al7 .2971 .2926 .3892 .25 .014
	Si8 .4193 .1693 .3862 .74 .016
	Al8 .4193 .1693 .3862 .26 .016
	Si9 .5 .1116 .25 .69 .016
	Al9 .5 .1116 .25 .31 .016
	O1 .2077 .9163 .8753 .032
	O2 .5784 .3306 .8014 .034
	O3 .2246 .7652 .8738 .033
	O4 .6681 .3329 .9996 .027
	O5 .2337 .4827 .2040 .032
	O6 .1451 .6024 .1324 .039
	O7 .1650 .5016 .0076 .026
	O8 .1672 .4554 .3359 .039
	O9 .2655 .3563 .3029 .041
	O10 .1153 .3825 .1592 .037
	O11 .4629 .0805 .6252 .047
	O12 .0637 .5621 .3419 .045
	O13 .5106 .2245 .6639 .041
	O14 .4987 .1623 .4944 .018
	O15 .3748 .2513 .3779 .032
	O16 .4506 .1689 .2959 .030
	Wat1 .156 .224 -.114 .58 .12
	Wat2 .118 .254 -.111 .45 .09
	Wat3 .286 .347 .117 .41 .07
	Wat4 .242 .378 -.108 .62 .11
	Wat5 .396 .427 .126 .17 .18
	Wat6 .478 .641 -.165 .26 .09
	Wat7 .013 .140 .025 .56 .14
	Wat8 .011 .021 -.019 .40 .04
	Wat9 .145 .011 .007 .61 .14
	Wat10 .091 .011 .194 .58 .14
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	Tschernichite
	Alberti A, Cruciani G, Galli E, Merlino S, Millini R, Quartieri S, Vezzalini G, Zanardi S
	Journal of Physical Chemistry B106 (2002) 10277-10284
	Crystal structure of tetragonal and monoclinic polytypes of tschernichite,
	the natural counterpart of synthetic zeolite beta
	Locality: Mt. Adamson, Northern Victoria Land, Antarctica
	Sample: small crystal, tetragonal
	Note: Mg position adjusted to match reported bond lengths
	_database_code_amcsd 0013154
	12.634 12.634 26.608 90 90 90 P4_122
	atom x y z occ Uiso
	Na -.291 -.300 .123 .04 .04
	Mg -.291 -.300 .123 .04 .04
	K1 0 -.123 0 .04 .11
	Ca1 0 -.123 0 .32 .11
	K2 0 .449 0 .03 .05
	Ca2 0 .449 0 .25 .05
	K3 -.5 -.318 0 .04 .10
	Ca3 -.5 -.318 0 .32 .10
	Si1 .4579 .2945 .0562 .70 .020
	Al1 .4579 .2945 .0562 .30 .020
	Si2 .4573 .0422 .0541 .90 .018
	Al2 .4573 .0422 .0541 .10 .018
	Si3 .2111 .2935 .0565 .85 .016
	Al3 .2111 .2935 .0565 .15 .016
	Si4 .2113 .0419 .0575 .83 .017
	Al4 .2113 .0419 .0575 .17 .017
	Si5 .8360 .2938 .0566 .99 .019
	Al5 .8360 .2938 .0566 .01 .019
	Si6 .8355 .0411 .0577 .76 .018
	Al6 .8355 .0411 .0577 .24 .018
	Si7 .0271 .3583 .1251 .78 .021
	Al7 .0271 .3583 .1251 .22 .021
	Si8 .0262 -.0262 .125 .71 .016
	Al8 .0262 -.0262 .125 .29 .016
	Si9 .6403 .3597 .125 .93 .019
	Al9 .6403 .3597 .125 .07 .019
	O1 .5 .3395 0 .023
	O2 .4691 .1639 .0608 .035
	O3 .3363 .3310 .0631 .039
	O4 .5267 .3542 .0994 .037
	O5 .5 .080 0 .030
	O6 .3340 .0018 .0626 .037
	O7 .5227 -.0180 .0993 .033
	O8 .2017 .1679 .0661 .047
	O9 .1643 .3224 .0018 .028
	O10 .1468 .3539 .1004 .036
	O11 .1641 .0056 .0024 .039
	O12 .1458 -.0208 .0998 .033
	O13 .8348 .1696 .0639 .050
	O14 .9374 .3480 .0809 .036
	O15 .7298 .3481 .0828 .057
	O16 .7296 -.0163 .0822 .035
	O17 .9412 -.0094 .0789 .050
	Wat1 -.186 -.229 .057 .55 .09
	Wat2 -.167 -.416 .056 .93 .22
	Wat3 0 .546 0 .38 .10
	Wat4 -.359 -.206 .005 .86 .19
	Wat6 -.463 -.323 .090 .67 .18
	Wat7 -.361 -.478 .006 .31 .11
	Wat10 -.155 -.346 -.002 .30 .06
	Wat11 -.334 -.334 -.125 .34 .08
	Wat13 0 -.203 0 .38 .05
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	Barrerite
	Sacerdoti M, Sani A, Vezzalini G
	Microporous and Mesoporous Materials 30 (1999) 103-109
	Structural refinement of two barrerites from Alaska
	Note: sample 1
	Locality: Kuiu Island, Alaska, USA
	_database_code_amcsd 0014404
	13.598 18.177 17.790 90 90 90 Amma
	atom x y z occ Uiso
	NaC1 .25 0 .0439 .52 .088
	CaC1p .25 0 .4569 .56 .054
	NaC2 .033 .064 .034 .30 .167
	KC2p .077 .072 .447 .216 .161
	NaC2p .077 .072 .447 .124 .161
	NaC3 .162 0 .246 .13 .085
	SiT1 .13546 .30410 .12498 .7792 .0134
	AlT1 .13546 .30410 .12498 .2208 .0134
	SiT1p .13613 .31174 .37241 .7792 .0142
	AlT1p .13613 .31174 .37241 .2208 .0142
	SiT3 .05102 .41097 .24369 .7792 .0140
	AlT3 .05102 .41097 .24369 .2208 .0140
	SiT4 .13870 .18434 .25369 .7792 .0127
	AlT4 .13870 .18434 .25369 .2208 .0127
	SiT5 0 .24037 0 .7792 .0166
	AlT5 0 .24037 0 .2208 .0166
	O1 .0706 .2950 .0488 .033
	O1p .0648 .3136 .4469 .0300
	O3 .1202 .2330 .1793 .033
	O3p .1245 .2331 .3292 .0277
	O4 .1036 .3801 .1666 .033
	O4p .1085 .3807 .3181 .034
	O7 .25 .3113 .0984 .030
	O7p .25 .3224 .4011 .025
	O8 .0658 .1139 .2546 .028
	O9 .0549 .5 .2431 .031
	O10 .25 .1506 .2521 .0228
	Wat1 .222 .123 .058 .51 .078
	Wat1p .167 .108 .444 .28 .102
	Wat2p .25 .127 .448 .58 .076
	Wat3 .192 0 .176 .29 .091
	Wat3p .229 0 .327 .24 .038
	Wat4 .123 0 .117 .56 .296
	Wat4p .178 0 .323 .42 .132
	Wat5 .178 .5 .078 .28 .042
	Wat5p .211 .5 .405 .19 .060
	Wat6 .107 .5 .066 .46 .076
	Wat6p .122 .5 .443 .48 .107
	Wat8 .25 .5 .098 .40 .068
	Wat8p .25 .5 .357 .61 .021
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
	Barrerite
	Sacerdoti M, Sani A, Vezzalini G
	Microporous and Mesoporous Materials 30 (1999) 103-109
	Structural refinement of two barrerites from Alaska
	Note: sample 3
	Locality: Kuiu Island, Alaska, USA
	_database_code_amcsd 0014405
	13.586 18.184 17.812 90 90 90 Amma
	atom x y z occ Uiso
	NaC1 .25 0 .0475 .23 .035
	CaC1p .25 0 .4564 .97 .053
	NaC2 .035 .068 .035 .12 .053
	KC2p .103 .089 .444 .42 .160
	NaC2p .103 .089 .444 .42 .160
	NaC3 .155 0 .250 .20 .132
	SiT1 .13522 .30239 .12446 .7792 .0112
	AlT1 .13522 .30239 .12446 .2208 .0112
	SiT1p .13671 .31363 .37182 .7792 .0117
	AlT1p .13671 .31363 .37182 .2208 .0117
	SiT3 .05197 .41066 .24084 .7792 .0123
	AlT3 .05197 .41066 .24084 .2208 .0123
	SiT4 .13828 .18534 .25519 .7792 .0112
	AlT4 .13828 .18534 .25519 .2208 .0112
	SiT5 0 .23602 0 .7792 .0137
	AlT5 0 .23602 0 .2208 .0137
	O1 .0734 .2907 .0481 .0289
	O1p .0648 .3189 .4444 .0253
	O3 .1174 .2348 .1815 .0329
	O3p .1257 .2333 .3317 .0247
	O4 .1027 .3799 .1624 .0305
	O4p .1122 .3807 .3151 .0305
	O7 .25 .3076 .0996 .0352
	O7p .25 .3245 .4019 .0230
	O8 .0658 .1151 .2570 .0295
	O9 .0564 .5 .2387 .0306
	O10 .25 .1520 .2523 .0259
	Wat1 .206 .118 .061 .18 .044
	Wat1p .192 .118 .446 .22 .051
	Wat2 .25 .1255 .0587 .63 .074
	Wat2p .25 .132 .448 .30 .052
	Wat3 .190 0 .177 .28 .078
	Wat3p .25 0 .325 .32 .041
	Wat4 .123 0 .135 .52 .158
	Wat4p .195 0 .325 .34 .054
	Wat5 .178 .5 .077 .28 .055
	Wat5p .178 .5 .413 .10 .052
	Wat6 .102 .5 .066 .71 .112
	Wat6p .108 .5 .453 .92 .166
	Wat8 .25 .5 .086 .12 .048
	Wat8p .25 .5 .3526 .10 .0184
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	Chabazite-Ca
	Alberti A, Galli E, Vezzalini G, Passaglia E, Zanazzi P F
	Zeolites 2 (1982) 303-309
	Position of cations and water molecules in hydrated chabazite.
	Natural and Na-, Ca-, Sr- and K-exchanged chabazites
	Locality: Keller, Nidda, Germany
	Note: Natural chabazite
	_database_code_amcsd 0017686
	9.428 9.428 9.428 94.14 94.14 94.14 R-3m
	atom x y z occ Biso
	K1 0 0 0 .01 4.80
	Mg1 0 0 0 .02 4.80
	Ca1 0 0 0 .1 4.80
	Sr1 0 0 0 .02 4.80
	K2 .1965 .1965 .1965 .03 2.0
	Mg2 .1965 .1965 .1965 .08 2.0
	Ca2 .1965 .1965 .1965 .29 2.0
	Sr2 .1965 .1965 .1965 .06 2.0
	K3 .406 .406 .406 .02 3.9
	Mg3 .406 .406 .406 .05 3.9
	Ca3 .406 .406 .406 .19 3.9
	Sr3 .406 .406 .406 .04 3.9
	K4 .579 .579 .233 .01 4.3
	Mg4 .579 .579 .233 .02 4.3
	Ca4 .579 .579 .233 .09 4.3
	Sr4 .579 .579 .233 .02 4.3
	Al1 .1035 .3338 .8741 .32 .82
	Si1 .1035 .3338 .8741 .68 .82
	O1 .2651 -.2651 0 2.64
	O2 .1536 -.1536 .5 1.72
	O3 .2494 .2494 .8947 2.68
	O4 .0214 .0214 .3234 2.53
	Wat1 .5 .5 0 10.9
	Wat2 .256 .256 .509 .54 11.40
	Wat3 .199 .357 .507 .33 13.0
	Wat4 .367 -.367 .5 .29 11.80
	Wat5 .585 .585 .316 .26 10.5
	Wat6 .248 .248 .248 .77 5.3
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	Chabazite-Na
	Alberti A, Galli E, Vezzalini G, Passaglia E, Zanazzi P F
	Zeolites 2 (1982) 303-309
	Position of cations and water molecules in hydrated chabazite.
	Natural and Na-, Ca-, Sr- and K-exchanged chabazites
	Locality: Keller, Nidda, Germany
	Note: Na-exchanged
	_database_code_amcsd 0017687
	9.425 9.425 9.425 94.06 94.06 94.06 R-3m
	atom x y z occ Biso
	Na1 .2013 .2013 .2013 .62 3.7
	Na2 .431 .431 .431 .21 3.2
	Na3 .572 .572 .223 .17 6.5
	Na4 .602 .504 .185 .04 3.1
	Al1 .1032 .3311 .8763 .31 1.01
	Si1 .1032 .3311 .8763 .69 1.01
	O1 .2640 -.2640 0 2.45
	O2 .1443 -.1443 .5 2.29
	O3 .2546 .2546 .8873 2.5
	O4 .0250 .0250 .3078 2.41
	Wat1 .5 .5 0 .90 9.8
	Wat2 .277 .277 .539 .17 6.6
	Wat3 .197 .305 .469 .22 5.8
	Wat4 .354 -.354 .5 .23 13.2
	Wat5 .621 .621 .386 .15 4.5
	Wat6 .253 .253 .253 .25 4.0
	Wat7 .368 .368 .193 .09 6.60
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	Chabazite-K
	Alberti A, Galli E, Vezzalini G, Passaglia E, Zanazzi P F
	Zeolites 2 (1982) 303-309
	Position of cations and water molecules in hydrated chabazite.
	Natural and Na-, Ca-, Sr- and K-exchanged chabazites
	Locality: Keller, Nidda, Germany
	Note: K-exchanged
	_database_code_amcsd 0017688
	9.442 9.442 9.442 94.29 94.29 94.29 R-3m
	atom x y z occ Biso
	Na1 .2249 .2249 .2249 .12 2.4
	K1 .2249 .2249 .2249 .84 2.4
	Na2 .388 .388 .388 .01 8.40
	K2 .388 .388 .388 .07 8.40
	Na3 .561 .561 .239 .01 9.4
	K3 .561 .561 .239 .1 9.4
	Na4 .529 .529 .107 .02 5.9
	K4 .529 .529 .107 .1 5.9
	Al1 .1040 .3332 .8755 .3 .84
	Si1 .1040 .3332 .8755 .7 .84
	O1 .2642 -.2642 0 2.59
	O2 .1494 -.1494 .5 1.91
	O3 .2497 .2497 .8919 2.12
	O4 .0226 .0226 .3200 2.15
	Wat1 .5 .5 0 .82 13.4
	Wat2 .264 .264 .526 .33 4.6
	Wat3 .196 .341 .518 .20 6.0
	Wat4 .352 -.379 .432 .19 11.10
	Wat5 .370 .370 .086 .15 9.60
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	Chabazite-Ca
	Alberti A, Galli E, Vezzalini G, Passaglia E, Zanazzi P F
	Zeolites 2 (1982) 303-309
	Position of cations and water molecules in hydrated chabazite.
	Natural and Na-, Ca-, Sr- and K-exchanged chabazites
	Locality: Keller, Nidda, Germany
	Note: Ca-exchanged
	_database_code_amcsd 0017689
	9.401 9.401 9.401 94.39 94.39 94.39 R-3m
	atom x y z occ Biso
	Ca1 0 0 0 .10 4.5
	Ca2 .193 .193 .193 .15 3.3
	Ca3 .408 .408 .408 .17 2.8
	Ca4 .579 .579 .231 .17 3.8
	Al1 .1046 .3336 .8763 .3 1.09
	Si1 .1046 .3336 .8763 .7 1.09
	O1 .2611 -.2611 0 2.87
	O2 .1533 -.1533 .5 2.23
	O3 .2545 .2545 .8927 2.81
	O4 .0268 .0268 .3262 2.91
	Wat1 .5 .5 0 .97 10.6
	Wat2 .237 .237 .519 .28 12.6
	Wat3 .246 .342 .543 .23 9.8
	Wat4 .365 -.365 .5 .09 5.20
	Wat5 .584 .584 .334 .13 4.70
	Wat6 .251 .251 .251 .60 4.9
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	Chabazite-Sr
	Alberti A, Galli E, Vezzalini G, Passaglia E, Zanazzi P F
	Zeolites 2 (1982) 303-309
	Position of cations and water molecules in hydrated chabazite.
	Natural and Na-, Ca-, Sr- and K-exchanged chabazites
	Locality: Keller, Nidda, Germany
	Note: Sr-exchanged
	_database_code_amcsd 0017690
	9.416 9.416 9.416 93.87 93.87 93.87 R-3m
	atom x y z occ Biso
	Sr1 0 0 0 .11 4.4
	Sr2 .1918 .1918 .1918 .31 2.8
	Sr3 .4133 .4133 .4133 .35 3.1
	Sr4 .571 .571 .270 .10 4.6
	Al1 .1030 .3338 .8726 .3 .98
	Si1 .1030 .3338 .8726 .7 .98
	O1 .2662 -.2662 0 2.52
	O2 .1541 -.1541 .5 1.93
	O3 .2465 .2465 .8933 2.64
	O4 .0196 .0196 .3253 2.13
	Wat1 .5 .5 0 .60 10.7
	Wat2 .238 .238 .496 .50 8.8
	Wat3 .148 .382 .502 .26 12.60
	Wat4 .354 -.354 .5 .23 12.30
	Wat5 .237 .237 .237 .55 2.6
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	Gismondine
	Vezzalini G, Quartieri S, Alberti A
	Zeolites 13 (1993) 34-42
	Structural modifications induced by dehydration in the zeolite gismondine
	Locality: Montalto di Castro, Italy
	Sample: dehydration t = 1 hr
	_database_code_amcsd 0015868
	9.989 10.616 9.820 90 92.57 90 *P2_1
	0 0 .25
	atom x y z Uiso
	Ca .7155 .0689 .3579 .022
	CaP .2837 .9337 .6407 .022
	Al1 .0965 .1149 .1679 .0069
	Al1f .0965 .3851 .6679 .0069
	Al2 .5873 .8645 .1468 .0064
	Al2f .5873 .6355 .6468 .0064
	Si1 .4163 .1129 .1836 .0062
	Si1f .4163 .3871 .6836 .0062
	Si2 .9073 .8717 .1616 .0058
	Si2f .9073 .6283 .6616 .0058
	O1 .0810 .1576 .9972 .014
	O1f .0810 .3424 .4972 .014
	O2 .2619 .0807 .2146 .013
	O2f .2619 .4193 .7146 .013
	O3 .4400 .1478 .0253 .011
	O3f .4400 .3522 .5253 .011
	O4 .2487 .4021 .3037 .013
	O4f .2487 .0979 .8037 .013
	O5 .9969 .9883 .2135 .013
	O5f .9969 .5117 .7135 .013
	O6 .0435 .2486 .2560 .009
	O6f .0435 .2514 .7560 .009
	O7 .4704 .2258 .2788 .010
	O7f .4704 .2742 .7788 .010
	O8 .5088 .9912 .2283 .010
	O8f .5088 .5088 .7283 .010
	Wat1 .2556 .1184 .4997 .026
	Wat1P .7480 .8992 .5069 .021
	Wat2 .5931 .1196 .5541 .017
	Wat2P .4034 .8553 .4582 .012
	Wat3 .9011 .1370 .4995 .013
	Wat3P .0846 .8948 .4948 .018
	Wat4 .7743 .2537 .2557 .023
	Wat7P .2286 .7763 .7834 .028
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	Gismondine
	Vezzalini G, Quartieri S, Alberti A
	Zeolites 13 (1993) 34-42
	Structural modifications induced by dehydration in the zeolite gismondine
	Locality: Montalto di Castro, Italy
	Sample: dehydration t = 24 hr
	_database_code_amcsd 0015869
	13.902 8.892 13.952 90 90 90 *P2_12_12_1
	.25 .25 .25
	atom x y z Uiso
	Ca1 .8233 .8366 .1344 .016
	Ca2 .6105 .0773 .5755 .028
	Al1 .7480 .7488 .9306 .014
	Al2 .2456 .7602 .1389 .014
	Al3 .4648 .1010 .1419 .011
	Al4 .9646 .1181 .6465 .014
	Si1 .8119 .9880 .4995 .010
	Si2 .3810 .5056 .5019 .012
	Si3 .9012 .1352 .2143 .011
	Si4 .3985 .1474 .7174 .012
	O1 .737 .081 .433 .021
	O2 .240 .090 .923 .010
	O3 .303 .637 .519 .006
	O4 .829 .656 .005 .013
	O5 .871 .860 .439 .009
	O6 .380 .893 .948 .017
	O7 .917 .966 .250 .008
	O8 .425 .977 .749 .021
	O9 .006 .714 .338 .008
	O10 .495 .701 .821 .010
	O11 .867 .742 .695 .012
	O12 .351 .765 .207 .013
	O13 .548 .984 .094 .008
	O14 .070 .028 .603 .012
	O15 .829 .116 .120 .015
	O16 .307 .129 .646 .016
	Wat1 .992 .611 .571 .029
	Wat2 .496 .640 .072 .047
	Wat3 .819 .604 .238 .030
	Wat4 .691 .881 .246 .039
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	Mutinaite
	Vezzalini G, Quartieri S, Galli E, Alberti A, Cruciani G, Kvick A
	Zeolites 19 (1997) 323-325
	Crystal structure of the zeolite mutinaite, the natural analog of ZSM-5
	Locality: Mt. Adamson, Northern Victoria Land, Antarctica
	Note: reported occupancies do not match reported chemistry
	_database_code_amcsd 0015873
	20.201 19.991 13.469 90 90 90 Pnma
	atom x y z occ Uiso
	Si1 .4254 .0571 .6788 .883 .018
	Al1 .4254 .0571 .6788 .117 .018
	Si2 .3177 .0298 .8333 .883 .022
	Al2 .3177 .0298 .8333 .117 .022
	Si3 .2783 .0626 .0495 .883 .023
	Al3 .2783 .0626 .0495 .117 .023
	Si4 .1226 .0629 .0443 .883 .018
	Al4 .1226 .0629 .0443 .117 .018
	Si5 .0757 .0299 .8312 .883 .016
	Al5 .0757 .0299 .8312 .117 .016
	Si6 .1964 .0583 .6936 .883 .021
	Al6 .1964 .0583 .6936 .117 .021
	Si7 .4277 .8292 .6911 .883 .018
	Al7 .4277 .8292 .6911 .117 .018
	Si8 .3177 .8718 .8369 .883 .020
	Al8 .3177 .8718 .8369 .117 .020
	Si9 .2712 .8274 .0452 .883 .019
	Al9 .2712 .8274 .0452 .117 .019
	Si10 .1175 .8269 .0393 .883 .018
	Al10 .1175 .8269 .0393 .117 .018
	Si11 .0739 .8716 .8304 .883 .019
	Al11 .0739 .8716 .8304 .117 .019
	Si12 .1973 .8274 .7041 .883 .020
	Al12 .1973 .8274 .7041 .117 .020
	O1 .3865 .0561 .7848 .043
	O2 .3176 .0617 -.0559 .044
	O3 .2018 .0604 .0292 .054
	O4 .0882 .0621 -.0641 .051
	O5 .1266 .0597 .7506 .046
	O6 .2560 .0572 .7697 .063
	O7 .3850 .8438 .7906 .040
	O8 .3146 .8435 -.0545 .052
	O9 .1941 .8451 .0283 .034
	O10 .0808 .8404 -.0629 .050
	O11 .1273 .8400 .7553 .057
	O12 .2553 .8489 .7716 .059
	O13 .3182 -.0493 .838 .103
	O14 .0837 -.0503 .8367 .057
	O15 .4146 .1297 .6267 .046
	O16 .4011 -.0006 .6084 .048
	O17 .3992 .8669 .5960 .040
	O18 .1986 .1303 .6354 .050
	O19 .1985 -.0008 .6143 .059
	O20 .1999 .8687 .6000 .052
	O21 .0030 .0500 .7937 .035
	O22 .0026 .8521 .7847 .035
	O23 .4272 .75 .666 .048
	O24 .2031 .75 .675 .061
	O25 .2811 .75 .077 .041
	O26 .1082 .75 .070 .031
	Ca .4840 .25 .923 .21 .023
	CaX1 .458 .035 .091 .016 .072
	NaX1 .458 .035 .091 .015 .072
	WatX1 .458 .035 .091 .299 .072
	CaX2 .070 .25 .459 .047 .082
	NaX2 .070 .25 .459 .044 .082
	WatX2 .070 .25 .459 .889 .082
	CaX3 .457 .25 .113 .025 .051
	NaX3 .457 .25 .113 .024 .051
	WatX3 .457 .25 .113 .481 .051
	CaX4 .191 .25 .010 .022 .111
	NaX4 .191 .25 .010 .021 .111
	WatX4 .191 .25 .010 .417 .111
	CaX5 .047 .163 .648 .034 .176
	NaX5 .047 .163 .648 .032 .176
	WatX5 .047 .163 .648 .644 .176
	CaX7 .060 .056 .519 .019 .219
	NaX6 .060 .056 .519 .017 .219
	WatX6 .060 .056 .519 .354 .219
	CaX7 .010 .059 .400 .016 .099
	NaX7 .010 .059 .400 .015 .099
	WatX7 .010 .059 .400 .299 .099
	CaX8 .419 .154 .955 .020 .121
	NaX8 .419 .154 .955 .019 .121
	WatX8 .419 .154 .955 .381 .121
	CaX9 .999 .138 .424 .010 .100
	NaX9 .999 .138 .424 .009 .100
	WatX9 .999 .138 .424 .191 .100
	CaX10 .486 .076 .904 .011 .093
	NaX10 .486 .076 .904 .010 .093
	WatX10 .486 .076 .904 .199 .093
	CaX11 .291 .25 .949 .010 .031
	NaX11 .291 .25 .949 .009 .031
	WatX11 .291 .25 .949 .181 .031
	CaX12 .435 .183 .038 .010 .041
	NaX12 .435 .183 .038 .009 .041
	WatX12 .435 .183 .038 .191 .041
	CaX13 .425 .25 .818 .015 .166
	NaX13 .425 .25 .818 .014 .166
	WatX13 .425 .25 .818 .281 .166
	CaX14 .157 .25 .786 .024 .174
	NaX14 .157 .25 .786 .022 .174
	WatX14 .157 .25 .786 .444 .174
	CaX15 .278 .218 .818 .016 .087
	NaX15 .278 .218 .818 .015 .087
	WatX15 .278 .218 .818 .309 .087
	CaX16 .058 .220 .922 .014 .125
	NaX16 .058 .220 .922 .014 .125
	WatX16 .058 .220 .922 .272 .125
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