Pargasite
	Raudsepp M, Turnock A C, Hawthorne F C, Sherriff B L, Hartman J S
	American Mineralogist 72 (1987) 580-593
	Characterization of synthetic pargasitic amphiboles
	(NaCa2Mg4M3+Si6Al2O22(OH,F)2; M3+ = Al,Cr,Ga,Sc,In) by infrared spectroscopy,
	Rietveld structure refinement, and 27Al, 29Si, and 19F MAS NMR spectroscopy
	Sample: ScPA-A5
	_database_code_amcsd 0001081
	9.9405 18.094 5.2986 90 105.364 90 C2/m
	atom x y z occ Biso
	O1 .117 .0935 .233 .8
	O2 .108 .1741 .712 .8
	OH3 .109 0 .713 .8
	O4 .352 .2495 .770 .8
	O5 .354 .1401 .119 1.1
	O6 .344 .1091 .638 1.1
	O7 .348 0 .290 1.2
	SiT1 .2824 .0820 .303 .75 .4
	AlT1 .2824 .0820 .303 .25 .4
	SiT2 .288 .1682 .811 .75 .4
	AlT2 .288 .1682 .811 .25 .4
	MgM1 0 .0865 .5 .6
	MgM2 0 .1751 0 .789 .6
	ScM2 0 .1751 0 .211 .6
	MgM3 0 0 0 .792 .6
	ScM3 0 0 0 .208 .6
	CaM4 0 .2811 .5 .9
	NaA 0 .5 0 2.3
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	Pargasite
	Raudsepp M, Turnock A C, Hawthorne F C, Sherriff B L, Hartman J S
	American Mineralogist 72 (1987) 580-593
	Characterization of synthetic pargasitic amphiboles
	(NaCa2Mg4M3+Si6Al2O22(OH,F)2; M3+ = Al,Cr,Ga,Sc,In) by infrared spectroscopy,
	Rietveld structure refinement, and 27Al, 29Si, and 19F MAS NMR spectroscopy
	Sample: FPA-BUL
	_database_code_amcsd 0001082
	9.8277 17.930 5.2931 90 105.168 90 C2/m
	atom x y z occ Biso
	O1 .119 .0868 .216 .8
	O2 .116 .1676 .740 .8
	F3 .106 0 .711 .8
	O4 .366 .2522 .782 .8
	O5 .357 .1380 .126 1.1
	O6 .341 .1091 .631 1.1
	O7 .348 0 .286 1.2
	SiT1 .2821 .0831 .309 .75 .4
	AlT1 .2821 .0831 .309 .25 .4
	SiT2 .2953 .1721 .809 .75 .4
	AlT2 .2953 .1721 .809 .25 .4
	MgM1 0 .0888 .5 .8 .6
	AlM1 0 .0888 .5 .2 .6
	MgM2 0 .1775 0 .8 .6
	AlM2 0 .1775 0 .2 .6
	MgM3 0 0 0 .8 .6
	AlM3 0 0 0 .2 .6
	CaM4 0 .2768 .5 .9
	NaA .024 .5 .057 .5 2.3
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	Pargasite
	Raudsepp M, Turnock A C, Hawthorne F C, Sherriff B L, Hartman J S
	American Mineralogist 72 (1987) 580-593
	Characterization of synthetic pargasitic amphiboles
	(NaCa2Mg4M3+Si6Al2O22(OH,F)2; M3+ = Al,Cr,Ga,Sc,In) by infrared spectroscopy,
	Rietveld structure refinement, and 27Al, 29Si, and 19F MAS NMR spectroscopy
	Sample: FCrPA-A3
	_database_code_amcsd 0001083
	9.8402 17.9800 5.2914 90 105.108 90 C2/m
	atom x y z occ Biso
	O1 .113 .0876 .212 .8
	O2 .114 .1703 .740 .8
	F3 .100 0 .714 .8
	O4 .359 .2498 .792 .8
	O5 .363 .1379 .134 1.1
	O6 .342 .1116 .622 1.1
	O7 .356 0 .295 1.2
	SiT1 .2817 .0824 .301 .75 .4
	AlT1 .2817 .0824 .301 .25 .4
	SiT2 .2924 .1703 .813 .75 .4
	AlT2 .2924 .1703 .813 .25 .4
	MgM1 0 .0879 .5 .92 .6
	CrM1 0 .0879 .5 .08 .6
	MgM2 0 .1767 0 .84 .6
	CrM2 0 .1767 0 .16 .6
	MgM3 0 0 0 .6
	CaM4 0 .2776 .5 .9
	NaA .031 .5 .072 .5 2.3
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	Pargasite
	Raudsepp M, Turnock A C, Hawthorne F C, Sherriff B L, Hartman J S
	American Mineralogist 72 (1987) 580-593
	Characterization of synthetic pargasitic amphiboles
	(NaCa2Mg4M3+Si6Al2O22(OH,F)2; M3+ = Al,Cr,Ga,Sc,In) by infrared spectroscopy,
	Rietveld structure refinement, and 27Al, 29Si, and 19F MAS NMR spectroscopy
	Sample: FGaPA-A3
	_database_code_amcsd 0001084
	9.8600 17.9685 5.3027 90 105.198 90 C2/m
	atom x y z occ Biso
	O1 .118 .0896 .221 .8
	O2 .106 .1703 .730 .8
	F3 .101 0 .709 .8
	O4 .359 .2487 .790 .8
	O5 .350 .1377 .116 1.1
	O6 .346 .1093 .615 1.1
	O7 .344 0 .278 1.2
	SiT1 .2844 .0842 .307 .75 .4
	AlT1 .2844 .0842 .307 .25 .4
	SiT2 .2893 .1707 .809 .75 .4
	AlT2 .2893 .1707 .809 .25 .4
	MgM1 0 .0875 .5 .6
	MgM2 0 .1749 0 .9 .6
	GaM2 0 .1749 0 .1 .6
	MgM3 0 0 0 .962 .6
	GaM3 0 0 0 .038 .6
	CaM4 0 .2786 .5 .9
	NaA .017 .5 .068 .5 2.3
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	Pargasite
	Raudsepp M, Turnock A C, Hawthorne F C, Sherriff B L, Hartman J S
	American Mineralogist 72 (1987) 580-593
	Characterization of synthetic pargasitic amphiboles
	(NaCa2Mg4M3+Si6Al2O22(OH,F)2; M3+ = Al,Cr,Ga,Sc,In) by infrared spectroscopy,
	Rietveld structure refinement, and 27Al, 29Si, and 19F MAS NMR spectroscopy
	Sample: FScPA-A3
	_database_code_amcsd 0001085
	9.8852 18.1574 5.3186 90 105.213 90 C2/m
	atom x y z occ Biso
	O1 .1108 .0864 .219 .8
	O2 .1138 .1709 .724 .8
	F .1008 0 .711 .8
	O4 .3598 .2468 .788 .8
	O5 .3535 .1388 .122 1.1
	O6 .3447 .1140 .620 1.1
	O7 .353 0 .291 1.2
	SiT1 .2838 .0833 .304 .75 .4
	AlT1 .2838 .0833 .304 .25 .4
	SiT2 .2909 .1692 .8090 .75 .4
	AlT2 .2909 .1692 .8090 .25 .4
	MgM1 0 .0870 .5 .922 .6
	ScM1 0 .0870 .5 .078 .6
	MgM2 0 .1763 0 .597 .6
	ScM2 0 .1763 0 .403 .6
	MgM3 0 0 0 .6
	CaM4 0 .2791 .5 .9
	NaA .029 .5 .068 .5 2.3
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	Pargasite
	Makino K, Tomita K
	American Mineralogist 74 (1989) 1097-1105
	Cation distribution in the octahedral sites of hornblendes
	sample I-P from Iratsu, Japan
	_database_code_amcsd 0001267
	9.805 17.96 5.302 90 104.93 90 C2/m
	atom x y z occ Biso
	Si1 .2809 .0858 .3014 .57 0.48
	Al1 .2809 .0858 .3014 .43 0.48
	Si2 .2919 .1731 .8133 .98 0.48
	Al2 .2919 .1731 .8133 .02 0.48
	Mg1 0 .0886 .5 .615 0.78
	Fe1 0 .0886 .5 .385 0.78
	Mg2 0 .1772 0 .816 0.49
	Fe2 0 .1772 0 .184 0.49
	Mg3 0 0 0 .481 0.62
	Fe3 0 0 0 .519 0.62
	Ca4 0 .2789 .5 .851 0.80
	Na4 0 .2789 .5 .092 0.80
	Fe4 0 .2789 .5 .057 0.80
	NaAm .0474 .5 .1014 .80 2.70
	NaA2 0 .4774 0 .80 2.16
	O1 .1070 .0896 .2145 0.95
	O2 .1204 .1742 .7366 0.77
	OH3 .1101 0 .7140 0.86
	O4 .3684 .2501 .7895 0.92
	O5 .3500 .1404 .1084 0.88
	O6 .3427 .1181 .6072 1.01
	O7 .3380 0 .2765 1.23
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	Pargasite
	Makino K, Tomita K
	American Mineralogist 74 (1989) 1097-1105
	Cation distribution in the octahedral sites of hornblendes
	sample E-P from Einstodingen, Antarctica
	_database_code_amcsd 0001268
	9.900 17.95 5.311 90 105.42 90 C2/m
	atom x y z occ Biso
	Si1 .2776 .0863 .3049 .50 0.44
	Al1 .2776 .0863 .3049 .50 0.44
	Si2 .2961 .1741 .8162 .99 0.47
	Al2 .2961 .1741 .8162 .01 0.47
	Mg1 0 .0903 .5 .822 0.92
	Fe1 0 .0903 .5 .178 0.92
	Mg2 0 .1768 0 .838 0.63
	Fe2 0 .1768 0 .162 0.63
	Mg3 0 0 0 .780 0.87
	Fe3 0 0 0 .220 0.87
	Ca4 0 .2809 .5 .995 0.67
	Na4 0 .2809 .5 .005 0.67
	NaAm .0203 .5 .0426 .94 1.73
	O1 .1045 .0902 .2148 0.83
	O2 .1204 .1750 .7375 0.82
	OH3 .1123 0 .7151 0.76
	O4 .3687 .2506 .7934 0.87
	O5 .3491 .1398 .1129 0.86
	O6 .3418 .1186 .6108 0.92
	O7 .3344 0 .2880 1.20
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	Pargasite
	Makino K, Tomita K
	American Mineralogist 74 (1989) 1097-1105
	Cation distribution in the octahedral sites of hornblendes
	sample P-P from Parau Island
	_database_code_amcsd 0001270
	9.834 18.01 5.297 90 105.04 90 C2/m
	atom x y z occ Biso
	Si1 .2816 .0852 .3009 .60 0.39
	Al1 .2816 .0852 .3009 .40 0.39
	Si2 .2914 .1725 .8113 .89 0.39
	Al2 .2914 .1725 .8113 .11 0.39
	Mg1 0 .0879 .5 .759 0.67
	Fe1 0 .0879 .5 .241 0.67
	Mg2 0 .1768 0 .763 0.41
	Fe2 0 .1768 0 .237 0.41
	Mg3 0 0 0 .764 0.47
	Fe3 0 0 0 .236 0.47
	Ca4 0 .2785 .5 .930 0.91
	Mg4 0 .2785 .5 .011 0.91
	Fe4 0 .2785 .5 .059 0.91
	NaAm .0292 .5 .1245 .57 2.48
	NaA2 0 .4793 0 .57 2.36
	O1 .1074 .0874 .2160 0.79
	O2 .1197 .1733 .7316 0.68
	OH3 .1087 0 .7157 0.84
	O4 .3672 .2497 .7875 0.90
	O5 .3495 .1403 .1100 0.90
	O6 .3440 .1165 .6070 0.99
	O7 .3393 0 .2745 1.08
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	Pargasite
	Hawthorne F C, Oberti R, Ungaretti L, Grice J D
	American Mineralogist 81 (1996) 995-1002
	A new hyper-calcic amphibole with Ca at the A site: Fluor-cannilloite from
	Pargas, Finland
	Sample: BMS
	_database_code_amcsd 0001826
	9.889 17.978 5.298 90 105.41 90 C2/m
	atom x y z occ Biso
	O1 .1064 .0872 .2179 .74
	O2 .1193 .1726 .7323 .70
	Oh3 .1056 0 .7143 .23 .79
	F3 .1056 0 .7143 .77 .79
	O4 .3660 .2508 .7916 .90
	O5 .3503 .1394 .1121 1.0
	O6 .3453 .1175 .6110 1.0
	O7 .3411 0 .2871 1.24
	Si1 .2798 .0855 .3051 .53 .49
	Al1 .2798 .0855 .3051 .47 .49
	Si2 .2903 .1733 .8141 .52
	Mg1 0 .0892 .5 .53
	Mg2 0 .1756 0 .71 .52
	Al2 0 .1756 0 .18 .52
	Ti2 0 .1756 0 .02 .52
	Fe2 0 .1756 0 .09 .52
	Mg3 0 0 0 .90 .56
	Fe3 0 0 0 .02 .56
	Al3 0 0 0 .08 .56
	Ca4 0 .2796 .5 .74
	NaA 0 .5 0 .15 .91
	KA 0 .5 0 .13 .91
	CaA 0 .5 0 .05 .91
	NaAm .0321 .5 .0681 .15 2.99
	KAm .0321 .5 .0681 .13 2.99
	CaAm .0321 .5 .0681 .05 2.99
	NaA2 0 .4729 0 .15 2.77
	KAm 0 .4729 0 .13 2.77
	CaA2 0 .4729 0 .05 2.77
	H .1688 0 .6402 7.9
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	Pargasite
	Sharma A, Jenkins D M
	American Mineralogist 84 (1999) 1304-1318
	Hydrothermal synthesis of amphiboles along the tremolite-pargasite join
	and in the ternary system tremolite-pargasite-cummingtonite
	Sample: PARG 11-7
	_database_code_amcsd 0002275
	9.8929 17.944 5.2804 90 105.505 90 C2/m
	atom x y z occ Biso
	O1 .1116 .0864 .2218 .8
	O2 .1173 .1726 .7274 .8
	O3 .1078 0 .7226 .8
	O4 .3605 .2500 .7826 .8
	O5 .3537 .1414 .1296 1.1
	O6 .3401 .1141 .6249 1.1
	O7 .3461 0 .2784 1.2
	Si1 .2822 .0855 .3082 .75 .4
	Al1 .2822 .0855 .3082 .25 .4
	Si2 .2888 .1722 .8113 .75 .4
	Al2 .2888 .1722 .8113 .25 .4
	Mg1 0 .0873 .5 .84 .6
	Al1 0 .0873 .5 .16 .6
	Mg2 0 .1765 .5 .84 .6
	Al2 0 .1765 .5 .16 .6
	Mg3 0 0 0 .84 .6
	Al3 0 0 0 .16 .6
	Ca4 0 .2794 .5 .93 .9
	Mg4 0 .2794 .5 .07 .9
	NaA 0 .5 0 .94 2.3
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	Pargasite
	Sharma A, Jenkins D M
	American Mineralogist 84 (1999) 1304-1318
	Hydrothermal synthesis of amphiboles along the tremolite-pargasite join
	and in the ternary system tremolite-pargasite-cummingtonite
	Sample: PARG 19-11
	_database_code_amcsd 0002276
	9.9022 17.9747 5.2750 90 105.384 90 C2/m
	atom x y z occ Biso
	O1 .1132 .0871 .2258 .8
	O2 .1142 .1712 .7248 .8
	O3 .1072 0 .7126 .8
	O4 .3609 .2489 .7814 .8
	O5 .3496 .1404 .1174 1.1
	O6 .3388 .1126 .6147 1.1
	O7 .3445 0 .2804 1.2
	Si1 .2830 .0849 .3052 .81 .4
	Al1 .2830 .0849 .3052 .19 .4
	Si2 .2882 .1715 .8081 .81 .4
	Al2 .2882 .1715 .8081 .19 .4
	Mg1 0 .0884 .5 .85 .6
	Al1 0 .0884 .5 .15 .6
	Mg2 0 .1765 .5 .85 .6
	Al2 0 .1765 .5 .15 .6
	Mg3 0 0 0 .85 .6
	Al3 0 0 0 .15 .6
	Ca4 0 .2799 .5 .85 .9
	Mg4 0 .2799 .5 .15 .9
	NaA 0 .5 0 2.3
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	Pargasite
	Sharma A, Jenkins D M
	American Mineralogist 84 (1999) 1304-1318
	Hydrothermal synthesis of amphiboles along the tremolite-pargasite join
	and in the ternary system tremolite-pargasite-cummingtonite
	Sample: PARG 20-2
	_database_code_amcsd 0002277
	9.8466 17.990 5.2793 90 105.099 90 C2/m
	atom x y z occ Biso
	O1 .1131 .0866 .2156 .8
	O2 .1104 .1705 .7224 .8
	O3 .1080 0 .7186 .8
	O4 .3561 .2478 .7820 .8
	O5 .3516 .1365 .1132 1.1
	O6 .3368 .1132 .6043 1.1
	O7 .3435 0 .2805 1.2
	Si1 .2815 .0858 .3013 .86 .4
	Al1 .2815 .0858 .3013 .14 .4
	Si2 .2880 .1714 .8061 .86 .4
	Al2 .2880 .1714 .8061 .14 .4
	Mg1 0 .0870 .5 .88 .6
	Al1 0 .0870 .5 .12 .6
	Mg2 0 .1763 .5 .88 .6
	Al2 0 .1763 .5 .12 .6
	Mg3 0 0 0 .88 .6
	Al3 0 0 0 .12 .6
	Ca4 0 .2776 .5 .92 .9
	Mg4 0 .2776 .5 .08 .9
	NaA 0 .5 0 .58 2.3
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	Pargasite
	Sharma A, Jenkins D M
	American Mineralogist 84 (1999) 1304-1318
	Hydrothermal synthesis of amphiboles along the tremolite-pargasite join
	and in the ternary system tremolite-pargasite-cummingtonite
	Sample: PARG 21-2
	_database_code_amcsd 0002278
	9.8184 18.021 5.2780 90 104.829 90 C2/m
	atom x y z occ Biso
	O1 .1108 .0864 .2187 .8
	O2 .1132 .1722 .7179 .8
	O3 .1084 0 .7183 .8
	O4 .3590 .2465 .7846 .8
	O5 .3442 .1352 .1022 1.1
	O6 .3429 .1155 .5954 1.1
	O7 .3371 0 .2932 1.2
	Si1 .2803 .0854 .2966 .90 .4
	Al1 .2803 .0854 .2966 .10 .4
	Si2 .2892 .1709 .8065 .90 .4
	Al2 .2892 .1709 .8065 .10 .4
	Mg1 0 .0873 .5 .92 .6
	Al1 0 .0873 .5 .08 .6
	Mg2 0 .1768 .5 .92 .6
	Al2 0 .1768 .5 .08 .6
	Mg3 0 0 0 .92 .6
	Al3 0 0 0 .08 .6
	Ca4 0 .2775 .5 .84 .9
	Mg4 0 .2775 .5 .16 .9
	NaA 0 .5 0 .43 2.3
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	Pargasite
	Sharma A, Jenkins D M
	American Mineralogist 84 (1999) 1304-1318
	Hydrothermal synthesis of amphiboles along the tremolite-pargasite join
	and in the ternary system tremolite-pargasite-cummingtonite
	Sample: PARG 18-3
	_database_code_amcsd 0002279
	9.8160 18.040 5.2775 90 104.741 90 C2/m
	atom x y z occ Biso
	O1 .1156 .0850 .2198 .8
	O2 .1139 .1718 .7194 .8
	O3 .1119 0 .7201 .8
	O4 .3587 .2465 .7867 .8
	O5 .3443 .1335 .1002 1.1
	O6 .3407 .1163 .5913 1.1
	O7 .3367 0 .2942 1.2
	Si1 .2816 .0843 .2979 .96 .4
	Al1 .2816 .0843 .2979 .04 .4
	Si2 .2881 .1704 .8032 .96 .4
	Al2 .2881 .1704 .8032 .04 .4
	Mg1 0 .0868 .5 .96 .6
	Al1 0 .0868 .5 .04 .6
	Mg2 0 .1767 .5 .96 .6
	Al2 0 .1767 .5 .04 .6
	Mg3 0 0 0 .96 .6
	Al3 0 0 0 .04 .6
	Ca4 0 .2773 .5 .91 .9
	Mg4 0 .2773 .5 .09 .9
	NaA 0 .5 0 .14 2.3
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	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 1
	_database_code_amcsd 0002351
	9.846 18.042 5.316 90 105.10 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10708 .08782 .21726 .0021 .0009 .0071 -.0001 .0009 -.0001
	O2 .11924 .17301 .73050 .0020 .0007 .0086 .0001 .0007 .0004
	O3 .10801 0 .71381 .37 .0020 .0010 .0111 0 .0009 0
	Oh3 .10801 0 .71381 .63 .0020 .0010 .0111 0 .0009 0
	O4 .36788 .24991 .78633 .0040 .0007 .0107 -.0004 .0014 .0005
	O5 .35003 .13995 .10990 .0024 .0011 .0106 .0000 .0008 .0013
	O6 .34473 .11608 .60886 .0026 .0013 .0117 .0003 .0010 -.0013
	O7 .34069 0 .27728 .0033 .0009 .0179 0 .0015 0
	SiT1 .28174 .08544 .30209 .75 .0015 .0004 .0054 -.0001 .0006 -.0001
	AlT1 .28174 .08544 .30209 .25 .0015 .0004 .0054 -.0001 .0006 -.0001
	SiT2 .29147 .17257 .81084 .75 .0015 .0005 .0048 -.0001 .0005 .0002
	AlT2 .29147 .17257 .81084 .25 .0015 .0005 .0048 -.0001 .0005 .0002
	AlM1 0 .08696 .5 .13 .0024 .0011 .0059 0 .0016 0
	FeM1 0 .08696 .5 .19 .0024 .0011 .0059 0 .0016 0
	TiM1 0 .08696 .5 .09 .0024 .0011 .0059 0 .0016 0
	MgM1 0 .08696 .5 .59 .0024 .0011 .0059 0 .0016 0
	AlM2 0 .17751 0 .13 .0018 .0005 .0057 0 .0010 0
	FeM2 0 .17751 0 .19 .0018 .0005 .0057 0 .0010 0
	TiM2 0 .17751 0 .09 .0018 .0005 .0057 0 .0010 0
	MgM2 0 .17751 0 .59 .0018 .0005 .0057 0 .0010 0
	AlM3 0 0 0 .13 .0022 .0003 .0051 0 .0002 0
	FeM3 0 0 0 .19 .0022 .0003 .0051 0 .0002 0
	TiM3 0 0 0 .09 .0022 .0003 .0051 0 .0002 0
	MgM3 0 0 0 .59 .0022 .0003 .0051 0 .0002 0
	MgM4 0 .27960 .5 .08 .0026 .0005 .0084 0 .0031 0
	FeM4 0 .27960 .5 .10 .0026 .0005 .0084 0 .0031 0
	CaM4 0 .27960 .5 .80 .0026 .0005 .0084 0 .0031 0
	NaM4 0 .27960 .5 .02 .0026 .0005 .0084 0 .0031 0
	NaA 0 .5 0 .25 .0154 .0015 .0312 0 .0214 0
	CaA 0 .5 0 .09 .0154 .0015 .0312 0 .0214 0
	NaAM .04691 .5 .10192 .25 .0166 .0017 .0361 0 .0177 0
	CaAM .04691 .5 .10192 .08 .0166 .0017 .0361 0 .0177 0
	NaA2 0 .47138 0 .25 .0077 .0014 .0414 0 .0154 0
	CaA2 0 .47138 0 .08 .0077 .0014 .0414 0 .0154 0
	H .18906 0 .76299 1.0000
	Mg42 0 .26270 .5 .08 1.6965
	Fe42 0 .26270 .5 .10 1.6965
	Ca42 0 .26270 .5 .80 1.6965
	Na42 0 .26270 .5 .02 1.6965
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 2
	_database_code_amcsd 0002352
	9.858 18.031 5.307 90 105.13 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10687 .08869 .21674 .0019 .0011 .0095 -.0003 .0006 -.0001
	O2 .11912 .17327 .73099 .0023 .0008 .0093 .0001 .0004 .0005
	O3 .10844 0 .71159 .51 .0024 .0013 .0111 0 .0005 0
	Oh3 .10844 0 .71159 .49 .0024 .0013 .0111 0 .0005 0
	O4 .36749 .25016 .78758 .0040 .0007 .0118 -.0003 .0018 .0003
	O5 .35022 .13943 .10833 .0025 .0010 .0100 .0000 .0009 .0010
	O6 .34489 .11727 .60653 .0027 .0012 .0125 .0002 .0010 -.0014
	O7 .33947 0 .28155 .0036 .0009 .0184 0 .0018 0
	SiT1 .28183 .08569 .30211 .74 .0015 .0004 .0057 -.0002 .0004 -.0001
	AlT1 .28183 .08569 .30211 .26 .0015 .0004 .0057 -.0002 .0004 -.0001
	SiT2 .29141 .17270 .81088 .74 .0016 .0005 .0053 -.0001 .0006 .0001
	AlT2 .29141 .17270 .81088 .26 .0016 .0005 .0053 -.0001 .0006 .0001
	AlM1 0 .08636 .5 .14 .0024 .0012 .0060 0 .0016 0
	TiM1 0 .08636 .5 .12 .0024 .0012 .0060 0 .0016 0
	FeM1 0 .08636 .5 .34 .0024 .0012 .0060 0 .0016 0
	MgM1 0 .08636 .5 .40 .0024 .0012 .0060 0 .0016 0
	AlM2 0 .17799 0 .14 .0017 .0004 .0062 0 .0008 0
	TiM2 0 .17799 0 .12 .0017 .0004 .0062 0 .0008 0
	FeM2 0 .17799 0 .34 .0017 .0004 .0062 0 .0008 0
	MgM2 0 .17799 0 .40 .0017 .0004 .0062 0 .0008 0
	AlM3 0 0 0 .14 .0024 .0004 .0055 0 .0004 0
	TiM3 0 0 0 .12 .0024 .0004 .0055 0 .0004 0
	FeM3 0 0 0 .34 .0024 .0004 .0055 0 .0004 0
	MgM3 0 0 0 .40 .0024 .0004 .0055 0 .0004 0
	MgM4 0 .27898 .5 .04 .0030 .0006 .0097 0 .0031 0
	FeM4 0 .27898 .5 .14 .0030 .0006 .0097 0 .0031 0
	CaM4 0 .27898 .5 .80 .0030 .0006 .0097 0 .0031 0
	NaM4 0 .27898 .5 .02 .0030 .0006 .0097 0 .0031 0
	NaA 0 .5 0 .23 .0101 .0011 .0448 0 .0205 0
	KA 0 .5 0 .10 .0101 .0011 .0448 0 .0205 0
	NaAM .05191 .5 .09947 .23 .0126 .0017 .0389 0 .0155 0
	KAM .05191 .5 .09947 .10 .0126 .0017 .0389 0 .0155 0
	NaA2 0 .47320 0 .24 .0089 .0017 .0490 0 .0154 0
	KA2 0 .47320 0 .10 .0089 .0017 .0490 0 .0154 0
	H .19476 0 .76271 1.0000
	MgM42 0 .25883 .5 .04 1.5183
	FeM42 0 .25883 .5 .14 1.5183
	CaM42 0 .25883 .5 .80 1.5183
	NaM42 0 .25883 .5 .02 1.5183
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 3
	_database_code_amcsd 0002353
	9.850 18.046 5.3160 90 105.10 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10668 .08854 .21645 .0018 .0010 .0078 -.0003 .0005 -.0003
	O2 .11938 .17320 .73225 .0020 .0007 .0099 .0001 .0007 .0005
	O3 .10816 0 .71216 .45 .0027 .0010 .0134 0 .0010 0
	F3 .10816 0 .71216 .01 .0027 .0010 .0134 0 .0010 0
	Oh3 .10816 0 .71216 .54 .0027 .0010 .0134 0 .0010 0
	O4 .36794 .25004 .78770 .0039 .0008 .0105 -.0004 .0018 .0004
	O5 .35059 .13968 .10886 .0023 .0011 .0097 .0000 .0006 .0015
	O6 .34497 .11659 .60822 .0023 .0012 .0106 .0003 .0006 -.0012
	O7 .33991 0 .27811 .0034 .0009 .0185 0 .0015 0
	SiT1 .28183 .08560 .30176 .75 .0015 .0004 .0052 -.0001 .0008 -.0001
	AlT1 .28183 .08560 .30176 .25 .0015 .0004 .0052 -.0001 .0008 -.0001
	SiT2 .29160 .17263 .81118 .75 .0015 .0004 .0053 -.0001 .0006 .0002
	AlT2 .29160 .17263 .81118 .25 .0015 .0004 .0053 -.0001 .0006 .0002
	AlM1 0 .08701 .5 .14 .0023 .0011 .0060 0 .0015 0
	FeM1 0 .08701 .5 .31 .0023 .0011 .0060 0 .0015 0
	TiM1 0 .08701 .5 .12 .0023 .0011 .0060 0 .0015 0
	MgM1 0 .08701 .5 .43 .0023 .0011 .0060 0 .0015 0
	AlM2 0 .17797 0 .14 .0016 .0004 .0053 0 .0007 0
	FeM2 0 .17797 0 .31 .0016 .0004 .0053 0 .0007 0
	TiM2 0 .17797 0 .12 .0016 .0004 .0053 0 .0007 0
	MgM2 0 .17797 0 .43 .0016 .0004 .0053 0 .0007 0
	AlM3 0 0 0 .14 .0023 .0003 .0048 0 .0001 0
	FeM3 0 0 0 .31 .0023 .0003 .0048 0 .0001 0
	TiM3 0 0 0 .12 .0023 .0003 .0048 0 .0001 0
	MgM3 0 0 0 .43 .0023 .0003 .0048 0 .0001 0
	MgM4 0 .27964 .5 .08 .0025 .0005 .0085 0 .0031 0
	FeM4 0 .27964 .5 .10 .0025 .0005 .0085 0 .0031 0
	CaM4 0 .27964 .5 .80 .0025 .0005 .0085 0 .0031 0
	NaM4 0 .27964 .5 .02 .0025 .0005 .0085 0 .0031 0
	NaA 0 .5 0 .26 .0112 .0007 .0546 0 .0218 0
	KA 0 .5 0 .08 .0112 .0007 .0546 0 .0218 0
	NaAM .05745 .5 .10702 .26 .0087 .0008 .0322 0 .0109 0
	KAM .05745 .5 .10702 .08 .0087 .0008 .0322 0 .0109 0
	NaA2 0 .47313 0 .25 .0134 .0009 .0681 0 .0271 0
	KA2 0 .47313 0 .07 .0134 .0009 .0681 0 .0271 0
	H .18953 0 .76031 1.0000
	MgM42 0 .26301 .5 .08 1.5581
	FeM42 0 .26301 .5 .10 1.5581
	CaM42 0 .26301 .5 .80 1.5581
	NaM42 0 .26301 .5 .02 1.5581
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	Sample 4
	_database_code_amcsd 0002354
	9.838 18.025 5.308 90 105.01 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10725 .08809 .21688 .0019 .0010 .0082 -.0002 .0008 -.0001
	O2 .11931 .17291 .73103 .0020 .0008 .0093 .0000 .0009 .0003
	O3 .10846 0 .71251 .46 .0023 .0010 .0116 0 .0011 0
	F3 .10846 0 .71251 .02 .0023 .0010 .0116 0 .0011 0
	Oh3 .10846 0 .71251 .52 .0023 .0010 .0116 0 .0011 0
	O4 .36779 .24994 .78632 .0039 .0007 .0113 -.0004 .0014 .0005
	O5 .35049 .13988 .10922 .0023 .0011 .0110 .0000 .0008 .0013
	O6 .34497 .11614 .60771 .0027 .0013 .0127 .0002 .0011 -.0015
	O7 .34124 0 .27543 .0031 .0009 .0165 0 .0017 0
	SiT1 .28228 .08544 .30173 .75 .0015 .0004 .0053 -.0001 .0004 -.0001
	AlT1 .28228 .08544 .30173 .25 .0015 .0004 .0053 -.0001 .0004 -.0001
	SiT2 .29176 .17251 .81053 .75 .0015 .0005 .0057 -.0001 .0008 .0001
	AlT2 .29176 .17251 .81053 .25 .0015 .0005 .0057 -.0001 .0008 .0001
	AlM1 0 .08694 .5 .16 .0023 .0011 .0062 0 .0018 0
	FeM1 0 .08694 .5 .24 .0023 .0011 .0062 0 .0018 0
	TiM1 0 .08694 .5 .12 .0023 .0011 .0062 0 .0018 0
	MgM1 0 .08694 .5 .48 .0023 .0011 .0062 0 .0018 0
	AlM2 0 .17793 0 .16 .0018 .0005 .0062 0 .0010 0
	FeM2 0 .17793 0 .24 .0018 .0005 .0062 0 .0010 0
	TiM2 0 .17793 0 .12 .0018 .0005 .0062 0 .0010 0
	MgM2 0 .17793 0 .48 .0018 .0005 .0062 0 .0010 0
	AlM3 0 0 0 .16 .0023 .0004 .0059 0 .0003 0
	FeM3 0 0 0 .24 .0023 .0004 .0059 0 .0003 0
	TiM3 0 0 0 .12 .0023 .0004 .0059 0 .0003 0
	MgM3 0 0 0 .48 .0023 .0004 .0059 0 .0003 0
	MgM4 0 .27935 .5 .06 .0029 .0006 .0097 0 .0033 0
	FeM4 0 .27935 .5 .14 .0029 .0006 .0097 0 .0033 0
	CaM4 0 .27935 .5 .74 .0029 .0006 .0097 0 .0033 0
	NaM4 0 .27935 .5 .06 .0029 .0006 .0097 0 .0033 0
	NaA 0 .5 0 .29 .0203 .0010 .0529 0 .0304 0
	KA 0 .5 0 .05 .0203 .0010 .0529 0 .0304 0
	NaAM .05291 .5 .11146 .29 .0120 .0016 .0301 0 .0144 0
	KAM .05291 .5 .11146 .05 .0120 .0016 .0301 0 .0144 0
	NaA2 0 .47208 0 .28 .0081 .0012 .0468 0 .0171 0
	KA2 0 .47208 0 .04 .0081 .0012 .0468 0 .0171 0
	H .19227 0 .76236 1.0000
	MgM42 0 .26163 .5 .06 1.2726
	FeM42 0 .26163 .5 .14 1.2726
	CaM42 0 .26163 .5 .74 1.2726
	NaM42 0 .26163 .5 .06 1.2726
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 5
	_database_code_amcsd 0002355
	9.806 18.026 5.308 90 104.91 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10756 .08769 .21629 .0025 .0009 .0089 -.0001 .0017 .0001
	O2 .11961 .17287 .73048 .0016 .0009 .0099 -.0001 .0006 .0005
	O3 .10908 0 .71249 .47 .0021 .0010 .0127 0 .0003 0
	F3 .10908 0 .71249 .01 .0021 .0010 .0127 0 .0003 0
	Oh3 .10908 0 .71249 .52 .0021 .0010 .0127 0 .0003 0
	O4 .36794 .25011 .78365 .0042 .0008 .0098 -.0005 .0004 .0006
	O5 .35154 .14012 .10885 .0029 .0011 .0122 .0000 .0014 .0015
	O6 .34593 .11587 .60694 .0026 .0014 .0111 .0003 .0009 -.0016
	O7 .34293 0 .27231 .0030 .0011 .0185 0 .0038 0
	SiT1 .28356 .08535 .30044 .74 .0014 .0004 .0052 -.0001 .0005 -.0002
	AlT1 .28356 .08535 .30044 .26 .0014 .0004 .0052 -.0001 .0005 -.0002
	SiT2 .29250 .17227 .80958 .74 .0015 .0005 .0053 -.0001 .0007 .0002
	AlT2 .29250 .17227 .80958 .26 .0015 .0005 .0053 -.0001 .0007 .0002
	AlM1 0 .08641 .5 .12 .0024 .0012 .0056 0 .0022 0
	FeM1 0 .08641 .5 .27 .0024 .0012 .0056 0 .0022 0
	TiM1 0 .08641 .5 .12 .0024 .0012 .0056 0 .0022 0
	MgM1 0 .08641 .5 .49 .0024 .0012 .0056 0 .0022 0
	AlM2 0 .17782 0 .12 .0018 .0005 .0047 0 .0009 0
	FeM2 0 .17782 0 .27 .0018 .0005 .0047 0 .0009 0
	TiM2 0 .17782 0 .12 .0018 .0005 .0047 0 .0009 0
	MgM2 0 .17782 0 .49 .0018 .0005 .0047 0 .0009 0
	AlM3 0 0 0 .12 .0019 .0004 .0062 0 -.0001 0
	FeM3 0 0 0 .27 .0019 .0004 .0062 0 -.0001 0
	TiM3 0 0 0 .12 .0019 .0004 .0062 0 -.0001 0
	MgM3 0 0 0 .49 .0019 .0004 .0062 0 -.0001 0
	MgM4 0 .27844 .5 .08 .0029 .0007 .0090 0 .0038 0
	FeM4 0 .27844 .5 .15 .0029 .0007 .0090 0 .0038 0
	CaM4 0 .27844 .5 .72 .0029 .0007 .0090 0 .0038 0
	NaM4 0 .27844 .5 .05 .0029 .0007 .0090 0 .0038 0
	NaA 0 .5 0 .33 .0296 .0013 .0792 0 .0449 0
	KA 0 .5 0 .00 .0296 .0013 .0792 0 .0449 0
	NaAM .06031 .5 .12244 .33 .0056 .0027 .0151 0 .0055 0
	KAM .06031 .5 .12244 .00 .0056 .0027 .0151 0 .0055 0
	NaA2 0 .47223 0 .34 .0067 .0013 .0393 0 .0148 0
	KA2 0 .47223 0 .00 .0067 .0013 .0393 0 .0148 0
	H .18755 0 .76700 1.0000
	MgM42 0 .25955 .5 .08 1.6837
	FeM42 0 .25955 .5 .15 1.6837
	CaM42 0 .25955 .5 .72 1.6837
	NaM42 0 .25955 .5 .05 1.6837
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 6
	_database_code_amcsd 0002356
	9.880 18.095 5.322 90 105.13 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10617 .08922 .21595 .0022 .0012 .0100 -.0003 .0009 -.0003
	O2 .11972 .17393 .73130 .0021 .0009 .0117 .0000 .0005 .0005
	O3 .10834 0 .71176 .42 .0025 .0013 .0130 0 .0008 0
	F3 .10834 0 .71176 .06 .0025 .0013 .0130 0 .0008 0
	Oh3 .10834 0 .71176 .52 .0025 .0013 .0130 0 .0008 0
	O4 .36821 .24976 .78791 .0043 .0008 .0127 -.0003 .0018 .0004
	O5 .34998 .13919 .10798 .0025 .0012 .0116 .0001 .0008 .0013
	O6 .34436 .11723 .60696 .0028 .0014 .0123 .0002 .0011 -.0012
	O7 .33837 0 .28153 .0037 .0010 .0194 0 .0014 0
	SiT1 .28114 .08571 .30215 .75 .0017 .0005 .0061 -.0001 .0004 -.0001
	AlT1 .28114 .08571 .30215 .25 .0017 .0005 .0061 -.0001 .0004 -.0001
	SiT2 .29150 .17263 .81119 .75 .0017 .0006 .0062 -.0001 .0006 .0002
	AlT2 .29150 .17263 .81119 .25 .0017 .0006 .0062 -.0001 .0006 .0002
	AlM1 0 .08753 .5 .16 .0030 .0013 .0083 0 .0017 0
	FeM1 0 .08753 .5 .46 .0030 .0013 .0083 0 .0017 0
	TiM1 0 .08753 .5 .09 .0030 .0013 .0083 0 .0017 0
	MgM1 0 .08753 .5 .29 .0030 .0013 .0083 0 .0017 0
	AlM2 0 .17832 0 .16 .0019 .0005 .0069 0 .0009 0
	FeM2 0 .17832 0 .46 .0019 .0005 .0069 0 .0009 0
	TiM2 0 .17832 0 .09 .0019 .0005 .0069 0 .0009 0
	MgM2 0 .17832 0 .29 .0019 .0005 .0069 0 .0009 0
	AlM3 0 0 0 .16 .0023 .0005 .0063 0 .0001 0
	FeM3 0 0 0 .46 .0023 .0005 .0063 0 .0001 0
	TiM3 0 0 0 .09 .0023 .0005 .0063 0 .0001 0
	MgM3 0 0 0 .29 .0023 .0005 .0063 0 .0001 0
	MgM4 0 .27902 .5 .00 .0029 .0007 .0101 0 .0030 0
	FeM4 0 .27902 .5 .13 .0029 .0007 .0101 0 .0030 0
	CaM4 0 .27902 .5 .82 .0029 .0007 .0101 0 .0030 0
	NaM4 0 .27902 .5 .04 .0029 .0007 .0101 0 .0030 0
	NaA 0 .5 0 .22 .0116 .0031 .0302 0 .0160 0
	KA 0 .5 0 .11 .0116 .0031 .0302 0 .0160 0
	NaAM .04354 .5 .08824 .22 .0161 .0015 .0474 0 .0231 0
	KAM .04354 .5 .08824 .11 .0161 .0015 .0474 0 .0231 0
	NaA2 0 .47101 0 .23 .0081 .0031 .0619 0 .0214 0
	KA2 0 .47101 0 .11 .0081 .0031 .0619 0 .0214 0
	H .18857 0 .75610 1.0000
	MgM42 0 .25756 .5 .00 1.1765
	FeM42 0 .25756 .5 .13 1.1765
	CaM42 0 .25756 .5 .82 1.1765
	NaM42 0 .25756 .5 .04 1.1765
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 7
	_database_code_amcsd 0002357
	9.862 18.003 5.296 90 105.19 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10721 .08694 .21866 .0019 .0007 .0079 -.0002 .0006 -.0001
	O2 .11911 .17231 .72949 .0017 .0008 .0079 -.0001 .0008 .0002
	O3 .10767 0 .71436 .0021 .0008 .0112 0 .0013 0
	F3 .10767 0 .71436 .0021 .0008 .0112 0 .0013 0
	Oh3 .10767 0 .71436 .0021 .0008 .0112 0 .0013 0
	O4 .36662 .24995 .78654 .0034 .0007 .0112 -.0004 .0016 .0003
	O5 .34949 .13969 .11029 .0021 .0011 .0096 .0000 .0003 .0012
	O6 .34483 .11572 .60960 .0024 .0011 .0125 .0001 .0016 -.0015
	O7 .34104 0 .27706 .0032 .0009 .0165 0 .0015 0
	SiT1 .28137 .08530 .30263 .75 .0015 .0004 .0049 -.0001 .0004 -.0001
	AlT1 .28137 .08530 .30263 .25 .0015 .0004 .0049 -.0001 .0004 -.0001
	SiT2 .29070 .17274 .81107 .75 .0014 .0005 .0050 -.0001 .0007 .0001
	AlT2 .29070 .17274 .81107 .25 .0014 .0005 .0050 -.0001 .0007 .0001
	AlM1 0 .08664 .5 .09 .0020 .0011 .0054 0 .0014 0
	FeM1 0 .08664 .5 .08 .0020 .0011 .0054 0 .0014 0
	TiM1 0 .08664 .5 .08 .0020 .0011 .0054 0 .0014 0
	MgM1 0 .08664 .5 .75 .0020 .0011 .0054 0 .0014 0
	AlM2 0 .17702 0 .09 .0018 .0005 .0058 0 .0010 0
	FeM2 0 .17702 0 .08 .0018 .0005 .0058 0 .0010 0
	TiM2 0 .17702 0 .08 .0018 .0005 .0058 0 .0010 0
	MgM2 0 .17702 0 .75 .0018 .0005 .0058 0 .0010 0
	AlM3 0 0 0 .09 .0022 .0004 .0056 0 .0002 0
	FeM3 0 0 0 .08 .0022 .0004 .0056 0 .0002 0
	TiM3 0 0 0 .08 .0022 .0004 .0056 0 .0002 0
	MgM3 0 0 0 .75 .0022 .0004 .0056 0 .0002 0
	MgM4 0 .27873 .5 .11 .0027 .0006 .0083 0 .0028 0
	FeM4 0 .27873 .5 .02 .0027 .0006 .0083 0 .0028 0
	CaM4 0 .27873 .5 .85 .0027 .0006 .0083 0 .0028 0
	NaM4 0 .27873 .5 .02 .0027 .0006 .0083 0 .0028 0
	NaA 0 .5 0 .26 .0048 .0024 .0220 0 .0091 0
	KA 0 .5 0 .08 .0048 .0024 .0220 0 .0091 0
	NaAM .04732 .5 .09659 .26 .0071 .0021 .0215 0 .0082 0
	KAM .04732 .5 .09659 .08 .0071 .0021 .0215 0 .0082 0
	NaA2 0 .46954 0 .25 .0068 .0011 .0348 0 .0083 0
	KA2 0 .46954 0 .07 .0068 .0011 .0348 0 .0083 0
	H .21780 0 .77457 .5757
	MgM42 0 .25434 .5 .11 .9489
	FeM42 0 .25434 .5 .02 .9489
	CaM42 0 .25434 .5 .85 .9489
	NaM42 0 .25434 .5 .02 .9489
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 8
	_database_code_amcsd 0002358
	9.853 18.060 5.314 90 105.07 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10689 .08862 .21697 .0022 .0010 .0082 -.0002 .0009 -.0002
	O2 .11962 .17324 .73142 .0018 .0008 .0097 .0001 .0003 .0005
	O3 .10880 0 .71210 .48 .0022 .0011 .0119 0 .0004 0
	F3 .10880 0 .71210 .02 .0022 .0011 .0119 0 .0004 0
	Oh3 .10880 0 .71210 .50 .0022 .0011 .0119 0 .0004 0
	O4 .36755 .25002 .78775 .0040 .0007 .0102 -.0003 .0015 .0003
	O5 .35031 .13919 .10787 .0023 .0011 .0106 -.0001 .0006 .0012
	O6 .34491 .11703 .60693 .0026 .0012 .0113 .0002 .0009 -.0013
	O7 .34012 0 .27921 .0034 .0009 .0171 0 .0010 0
	SiT1 .28177 .08558 .30185 .74 .0014 .0004 .0055 -.0001 .0003 -.0001
	AlT1 .28177 .08558 .30185 .26 .0014 .0004 .0055 -.0001 .0003 -.0001
	SiT2 .29146 .17254 .81068 .74 .0015 .0005 .0054 -.0001 .0005 .0001
	AlT2 .29146 .17254 .81068 .26 .0015 .0005 .0054 -.0001 .0005 .0001
	AlM1 0 .08687 .5 .13 .0022 .0011 .0061 0 .0013 0
	FeM1 0 .08687 .5 .37 .0022 .0011 .0061 0 .0013 0
	TiM1 0 .08687 .5 .11 .0022 .0011 .0061 0 .0013 0
	MgM1 0 .08687 .5 .39 .0022 .0011 .0061 0 .0013 0
	AlM2 0 .17816 0 .13 .0017 .0004 .0058 0 .0007 0
	FeM2 0 .17816 0 .37 .0017 .0004 .0058 0 .0007 0
	TiM2 0 .17816 0 .11 .0017 .0004 .0058 0 .0007 0
	MgM2 0 .17816 0 .39 .0017 .0004 .0058 0 .0007 0
	AlM3 0 0 0 .13 .0023 .0004 .0054 0 .0001 0
	FeM3 0 0 0 .37 .0023 .0004 .0054 0 .0001 0
	TiM3 0 0 0 .11 .0023 .0004 .0054 0 .0001 0
	MgM3 0 0 0 .39 .0023 .0004 .0054 0 .0001 0
	MgM4 0 .27929 .5 .04 .0029 .0006 .0099 0 .0031 0
	FeM4 0 .27929 .5 .12 .0029 .0006 .0099 0 .0031 0
	CaM4 0 .27929 .5 .79 .0029 .0006 .0099 0 .0031 0
	NaM4 0 .27929 .5 .05 .0029 .0006 .0099 0 .0031 0
	NaA 0 .5 0 .26 .0095 .0005 .0391 0 .0192 0
	KA 0 .5 0 .77 .0095 .0005 .0391 0 .0192 0
	NaAM .05351 .5 .10405 .26 .0131 .0015 .0360 0 .0141 0
	KAM .05351 .5 .10405 .77 .0131 .0015 .0360 0 .0141 0
	NaA2 0 .47348 0 .26 .0118 .0019 .0594 0 .0204 0
	KA2 0 .47348 0 .77 .0118 .0019 .0594 0 .0204 0
	H .20647 0 .75928 1.0000
	MgM42 0 .26032 .5 .04 1.1776
	FeM42 0 .26032 .5 .12 1.1776
	CaM42 0 .26032 .5 .79 1.1776
	NaM42 0 .26032 .5 .05 1.1776
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 9
	_database_code_amcsd 0002359
	9.873 18.060 5.315 90 105.17 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10666 .08844 .21720 .0020 .0009 .0094 -.0002 .0010 -.0002
	O2 .11876 .17293 .73091 .0019 .0008 .0094 .0000 .0003 .0005
	O3 .10793 0 .71244 .49 .0021 .0011 .0121 0 .0003 0
	F3 .10793 0 .71244 .02 .0021 .0011 .0121 0 .0003 0
	Oh3 .10793 0 .71244 .49 .0021 .0011 .0121 0 .0003 0
	O4 .36719 .25015 .78815 .0040 .0007 .0112 -.0003 .0015 .0002
	O5 .35037 .13923 .10890 .0022 .0011 .0116 .0000 .0007 .0012
	O6 .34473 .11706 .60763 .0025 .0012 .0125 .0001 .0013 -.0014
	O7 .34001 0 .28010 .0035 .0009 .0174 0 .0012 0
	SiT1 .28161 .08563 .30244 .75 .0015 .0004 .0053 -.0001 .0003 -.0001
	AlT1 .28161 .08563 .30244 .25 .0015 .0004 .0053 -.0001 .0003 -.0001
	SiT2 .29112 .17256 .81135 .75 .0014 .0005 .0052 -.0001 .0004 .0001
	AlT2 .29112 .17256 .81135 .25 .0014 .0005 .0052 -.0001 .0004 .0001
	AlM1 0 .08668 .5 .11 .0022 .0011 .0059 0 .0013 0
	FeM1 0 .08668 .5 .28 .0022 .0011 .0059 0 .0013 0
	TiM1 0 .08668 .5 .13 .0022 .0011 .0059 0 .0013 0
	MgM1 0 .08668 .5 .48 .0022 .0011 .0059 0 .0013 0
	AlM2 0 .17808 0 .11 .0018 .0005 .0064 0 .0008 0
	FeM2 0 .17808 0 .28 .0018 .0005 .0064 0 .0008 0
	TiM2 0 .17808 0 .13 .0018 .0005 .0064 0 .0008 0
	MgM2 0 .17808 0 .48 .0018 .0005 .0064 0 .0008 0
	AlM3 0 0 0 .11 .0025 .0004 .0064 0 0 0
	FeM3 0 0 0 .28 .0025 .0004 .0064 0 0 0
	TiM3 0 0 0 .13 .0025 .0004 .0064 0 0 0
	MgM3 0 0 0 .28 .0025 .0004 .0064 0 0 0
	MgM4 0 .27879 .5 .04 .0028 .0007 .0098 0 .0029 0
	FeM4 0 .27879 .5 .10 .0028 .0007 .0098 0 .0029 0
	CaM4 0 .27879 .5 .82 .0028 .0007 .0098 0 .0029 0
	NaM4 0 .27879 .5 .04 .0028 .0007 .0098 0 .0029 0
	NaA 0 .5 0 .24 .0185 .0020 .0456 0 .0285 0
	KA 0 .5 0 .09 .0185 .0020 .0456 0 .0285 0
	NaAM .04721 .5 .10194 .24 .0152 .0013 .0369 0 .0171 0
	KAM .04721 .5 .10194 .09 .0152 .0013 .0369 0 .0171 0
	NaA2 0 .47344 0 .24 .0150 .0022 .0707 0 .0270 0
	KA2 0 .47344 0 .09 .0150 .0022 .0707 0 .0270 0
	H .14814 0 .45519 1.0000
	MgM42 0 .25509 .5 .04 .8573
	FeM42 0 .25509 .5 .10 .8573
	CaM42 0 .25509 .5 .82 .8573
	NaM42 0 .25509 .5 .04 .8573
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 10
	_database_code_amcsd 0002360
	9.865 18.059 5.314 90 105.08 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10707 .08827 .21662 .0020 .0010 .0079 -.0001 .0006 -.0001
	O2 .11946 .17302 .73086 .0021 .0007 .0087 .0001 .0003 .0006
	O3 .10819 0 .71252 .45 .0020 .0011 .0134 0 .0011 0
	F3 .10819 0 .71252 .02 .0020 .0011 .0134 0 .0011 0
	Oh3 .10819 0 .71252 .53 .0020 .0011 .0134 0 .0011 0
	O4 .36752 .24969 .78788 .0040 .0007 .0105 -.0003 .0016 .0005
	O5 .35005 .13930 .10825 .0024 .0011 .0093 -.0001 .0005 .0013
	O6 .34471 .11667 .60706 .0024 .0012 .0117 .0002 .0010 -.0012
	O7 .34018 0 .27808 .0030 .0009 .0164 0 .0006 0
	SiT1 .28158 .08550 .30178 .75 .0015 .0004 .0052 -.0001 .0006 -.0001
	AlT1 .28158 .08550 .30178 .25 .0015 .0004 .0052 -.0001 .0006 -.0001
	SiT2 .29123 .17251 .81041 .75 .0015 .0004 .0050 -.0001 .0006 .0001
	AlT2 .29123 .17251 .81041 .25 .0015 .0004 .0050 -.0001 .0006 .0001
	AlM1 0 .08707 .5 .13 .0024 .0010 .0058 0 .0017 0
	FeM1 0 .08707 .5 .32 .0024 .0010 .0058 0 .0017 0
	TiM1 0 .08707 .5 .11 .0024 .0010 .0058 0 .0017 0
	MgM1 0 .08707 .5 .44 .0024 .0010 .0058 0 .0017 0
	AlM2 0 .17802 0 .13 .0017 .0005 .0064 0 .0010 0
	FeM2 0 .17802 0 .32 .0017 .0005 .0064 0 .0010 0
	TiM2 0 .17802 0 .11 .0017 .0005 .0064 0 .0010 0
	MgM2 0 .17802 0 .44 .0017 .0005 .0064 0 .0010 0
	AlM3 0 0 0 .13 .0022 .0003 .0054 0 .0001 0
	FeM3 0 0 0 .32 .0022 .0003 .0054 0 .0001 0
	TiM3 0 0 0 .11 .0022 .0003 .0054 0 .0001 0
	MgM3 0 0 0 .44 .0022 .0003 .0054 0 .0001 0
	MgM4 0 .27856 .5 .06 .0029 .0007 .0097 0 .0032 0
	FeM4 0 .27856 .5 .12 .0029 .0007 .0097 0 .0032 0
	CaM4 0 .27856 .5 .79 .0029 .0007 .0097 0 .0032 0
	NaM4 0 .27856 .5 .03 .0029 .0007 .0097 0 .0032 0
	NaA 0 .5 0 .26 .0109 .0020 .0524 0 .0234 0
	KA 0 .5 0 .07 .0109 .0020 .0524 0 .0234 0
	NaAM .05402 .5 .10389 .26 .0103 .0008 .0291 0 .0111 0
	KAM .05402 .5 .10389 .07 .0103 .0008 .0291 0 .0111 0
	NaA2 0 .47186 0 .27 .0137 .0022 .0593 0 .0224 0
	KA2 0 .47186 0 .07 .0137 .0022 .0593 0 .0224 0
	H .18507 0 .75975 1.0000
	MgM42 0 .25700 .5 .06 1.4282
	FeM42 0 .25700 .5 .12 1.4282
	CaM42 0 .25700 .5 .79 1.4282
	NaM42 0 .25700 .5 .03 1.4282
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 11
	_database_code_amcsd 0002361
	9.856 18.057 5.316 90 105.07 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10702 .08822 .21762 .0021 .0010 .0081 -.0002 .0004 -.0002
	O2 .11917 .17288 .73038 .0019 .0008 .0093 .0000 .0005 .0003
	O3 .10848 0 .71242 .53 .0026 .0011 .0109 0 .0008 0
	F3 .10848 0 .71242 .02 .0026 .0011 .0109 0 .0008 0
	Oh3 .10848 0 .71242 .45 .0026 .0011 .0109 0 .0008 0
	O4 .36725 .25006 .78720 .0040 .0007 .0117 -.0003 .0017 .0003
	O5 .35022 .13930 .10769 .0022 .0011 .0106 .0000 .0005 .0013
	O6 .34514 .11699 .60686 .0026 .0012 .0114 .0002 .0012 -.0012
	O7 .34044 0 .28001 .0033 .0009 .0186 0 .0015 0
	SiT1 .28202 .08556 .30204 .74 .0016 .0004 .0055 -.0001 .0004 -.0001
	AlT1 .28202 .08556 .30204 .26 .0016 .0004 .0055 -.0001 .0004 -.0001
	SiT2 .29136 .17257 .81061 .74 .0016 .0005 .0052 -.0001 .0006 .0001
	AlT2 .29136 .17257 .81061 .26 .0016 .0005 .0052 -.0001 .0006 .0001
	AlM1 0 .08611 .5 .13 .0023 .0013 .0057 0 .0015 0
	FeM1 0 .08611 .5 .29 .0023 .0013 .0057 0 .0015 0
	TiM1 0 .08611 .5 .13 .0023 .0013 .0057 0 .0015 0
	MgM1 0 .08611 .5 .45 .0023 .0013 .0057 0 .0015 0
	AlM2 0 .17794 0 .13 .0018 .0005 .0060 0 .0008 0
	FeM2 0 .17794 0 .29 .0018 .0005 .0060 0 .0008 0
	TiM2 0 .17794 0 .13 .0018 .0005 .0060 0 .0008 0
	MgM2 0 .17794 0 .45 .0018 .0005 .0060 0 .0008 0
	AlM3 0 0 0 .13 .0023 .0004 .0054 0 .0001 0
	FeM3 0 0 0 .29 .0023 .0004 .0054 0 .0001 0
	TiM3 0 0 0 .13 .0023 .0004 .0054 0 .0001 0
	MgM3 0 0 0 .45 .0023 .0004 .0054 0 .0001 0
	MgM4 0 .27858 .5 .06 .0029 .0007 .0096 0 .0030 0
	FeM4 0 .27858 .5 .13 .0029 .0007 .0096 0 .0030 0
	CaM4 0 .27858 .5 .78 .0029 .0007 .0096 0 .0030 0
	NaM4 0 .27858 .5 .03 .0029 .0007 .0096 0 .0030 0
	NaA 0 .5 0 .24 .0233 .0011 .0495 0 .0339 0
	KA 0 .5 0 .09 .0233 .0011 .0495 0 .0339 0
	NaAM .04893 .5 .10564 .24 .0148 .0013 .0313 0 .0175 0
	KAM .04893 .5 .10564 .09 .0148 .0013 .0313 0 .0175 0
	NaA2 0 .47307 0 .24 .0117 .0018 .0649 0 .0233 0
	KA2 0 .47307 0 .09 .0117 .0018 .0649 0 .0233 0
	H -.79732 0 .04358 1.0000
	MgM42 0 .25697 .5 .06 1.2224
	FeM42 0 .25697 .5 .13 1.2224
	CaM42 0 .25697 .5 .78 1.2224
	NaM42 0 .25697 .5 .03 1.2224
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 12
	_database_code_amcsd 0002362
	9.862 18.063 5.319 90 105.06 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10656 .08920 .21610 .0024 .0010 .0084 -.0002 .0010 -.0002
	O2 .11960 .17386 .73234 .0019 .0008 .0108 .0001 .0008 .0006
	O3 .10832 0 .71187 .35 .0023 .0010 .0129 0 .0008 0
	F3 .10832 0 .71187 .02 .0023 .0010 .0129 0 .0008 0
	Oh3 .10832 0 .71187 .63 .0023 .0010 .0129 0 .0008 0
	O4 .36807 .25002 .78748 .0042 .0007 .0119 -.0003 .0016 .0004
	O5 .35039 .13935 .10800 .0026 .0011 .0102 .0000 .0012 .0014
	O6 .34431 .11663 .60752 .0028 .0013 .0129 .0002 .0011 -.0013
	O7 .33955 0 .27843 .0032 .0009 .0182 0 .0015 0
	SiT1 .28146 .08569 .30172 .74 .0016 .0004 .0057 -.0001 .0006 -.0001
	AlT1 .28146 .08569 .30172 .26 .0016 .0004 .0057 -.0001 .0006 -.0001
	SiT2 .29166 .17262 .81122 .74 .0016 .0005 .0056 -.0001 .0006 .0001
	AlT2 .29166 .17262 .81122 .26 .0016 .0005 .0056 -.0001 .0006 .0001
	AlM1 0 .08744 .5 .13 .0023 .0011 .0054 0 .0014 0
	FeM1 0 .08744 .5 .43 .0023 .0011 .0054 0 .0014 0
	TiM1 0 .08744 .5 .07 .0023 .0011 .0054 0 .0014 0
	MgM1 0 .08744 .5 .37 .0023 .0011 .0054 0 .0014 0
	AlM2 0 .17822 0 .13 .0019 .0005 .0069 0 .0011 0
	FeM2 0 .17822 0 .43 .0019 .0005 .0069 0 .0011 0
	TiM2 0 .17822 0 .07 .0019 .0005 .0069 0 .0011 0
	MgM2 0 .17822 0 .37 .0019 .0005 .0069 0 .0011 0
	AlM3 0 0 0 .13 .0022 .0004 .0060 0 .0003 0
	FeM3 0 0 0 .43 .0022 .0004 .0060 0 .0003 0
	TiM3 0 0 0 .07 .0022 .0004 .0060 0 .0003 0
	MgM3 0 0 0 .37 .0022 .0004 .0060 0 .0003 0
	MgM4 0 .27873 .5 .00 .0031 .0009 .0100 0 .0034 0
	FeM4 0 .27873 .5 .15 .0031 .0009 .0100 0 .0034 0
	CaM4 0 .27873 .5 .79 .0031 .0009 .0100 0 .0034 0
	NaM4 0 .27873 .5 .06 .0031 .0009 .0100 0 .0034 0
	NaA 0 .5 0 .25 .0154 .0020 .0391 0 .0229 0
	KA 0 .5 0 .08 .0154 .0020 .0391 0 .0229 0
	NaAM .04892 .5 .10030 .25 .0155 .0019 .0440 0 .0198 0
	KAM .04892 .5 .10030 .08 .0155 .0019 .0440 0 .0198 0
	NaA2 0 .47165 0 .25 .0067 .0025 .0465 0 .0148 0
	KA2 0 .47165 0 .09 .0067 .0025 .0465 0 .0148 0
	H .19030 0 .76353 1.0000
	MgM42 0 .25674 .5 .00 1.3619
	FeM42 0 .25674 .5 .15 1.3619
	CaM42 0 .25674 .5 .79 1.3619
	NaM42 0 .25674 .5 .06 1.3619
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 13
	_database_code_amcsd 0002363
	9.857 18.037 5.310 90 105.09 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10686 .08881 .21668 .0020 .0011 .0090 -.0003 .0011 .0001
	O2 .11980 .17365 .73258 .0022 .0008 .0104 .0000 .0007 .0005
	O3 .10872 0 .71231 .35 .0021 .0011 .0105 0 -.0002 0
	F3 .10872 0 .71231 .02 .0021 .0011 .0105 0 -.0002 0
	Oh3 .10872 0 .71231 .63 .0021 .0011 .0105 0 -.0002 0
	O4 .36809 .24993 .78650 .0042 .0007 .0102 -.0003 .0019 .0005
	O5 .35042 .13965 .10915 .0022 .0011 .0097 .0000 .0007 .0013
	O6 .34421 .11652 .60824 .0024 .0013 .0125 .0001 .0011 -.0013
	O7 .33924 0 .27913 .0037 .0009 .0175 0 .0021 0
	SiT1 .28131 .08563 .30234 .73 .0015 .0004 .0053 -.0001 .0005 -.0001
	AlT1 .28131 .08563 .30234 .27 .0015 .0004 .0053 -.0001 .0005 -.0001
	SiT2 .29146 .17262 .81103 .73 .0016 .0005 .0056 -.0001 .0008 .0000
	AlT2 .29146 .17262 .81103 .27 .0016 .0005 .0056 -.0001 .0008 .0000
	AlM1 0 .08738 .5 .13 .0022 .0010 .0046 0 .0015 0
	FeM1 0 .08738 .5 .36 .0022 .0010 .0046 0 .0015 0
	TiM1 0 .08738 .5 .09 .0022 .0010 .0046 0 .0015 0
	MgM1 0 .08738 .5 .42 .0022 .0010 .0046 0 .0015 0
	AlM2 0 .17800 0 .13 .0018 .0005 .0071 0 .0012 0
	FeM2 0 .17800 0 .36 .0018 .0005 .0071 0 .0012 0
	TiM2 0 .17800 0 .09 .0018 .0005 .0071 0 .0012 0
	MgM2 0 .17800 0 .42 .0018 .0005 .0071 0 .0012 0
	AlM3 0 0 0 .13 .0023 .0004 .0056 0 .0003 0
	FeM3 0 0 0 .36 .0023 .0004 .0056 0 .0003 0
	TiM3 0 0 0 .09 .0023 .0004 .0056 0 .0003 0
	MgM3 0 0 0 .42 .0023 .0004 .0056 0 .0003 0
	MgM4 0 .27824 .5 .00 .0029 .0009 .0097 0 .0031 0
	FeM4 0 .27824 .5 .16 .0029 .0009 .0097 0 .0031 0
	CaM4 0 .27824 .5 .79 .0029 .0009 .0097 0 .0031 0
	NaM4 0 .27824 .5 .05 .0029 .0009 .0097 0 .0031 0
	NaA 0 .5 0 .25 .0266 .0011 .0502 0 .0363 0
	KA 0 .5 0 .09 .0266 .0011 .0502 0 .0363 0
	NaAM .04505 .5 .10565 .25 .0200 .0019 .0468 0 .0238 0
	KAM .04505 .5 .10565 .09 .0200 .0019 .0468 0 .0238 0
	NaA2 0 .47198 0 .24 .0081 .0022 .0402 0 .0142 0
	KA2 0 .47198 0 .08 .0081 .0022 .0402 0 .0142 0
	H .18517 0 .77373 .0032
	MgM42 0 .25144 .5 .00 .9642
	FeM42 0 .25144 .5 .16 .9642
	CaM42 0 .25144 .5 .79 .9642
	NaM42 0 .25144 .5 .05 .9642
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 14
	_database_code_amcsd 0002364
	9.898 18.112 5.324 90 105.18 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10687 .08854 .21707 .0021 .0010 .0090 -.0003 .0009 -.0003
	O2 .11981 .17327 .73009 .0019 .0008 .0106 .0001 .0007 .0004
	O3 .10816 0 .71238 .52 .0026 .0011 .0130 0 .0007 0
	F3 .10816 0 .71238 .02 .0026 .0011 .0130 0 .0007 0
	Oh3 .10816 0 .71238 .46 .0026 .0011 .0130 0 .0007 0
	O4 .36690 .24944 .78786 .0040 .0007 .0107 -.0003 .0021 .0001
	O5 .34931 .13872 .10742 .0023 .0010 .0108 .0000 .0011 .0013
	O6 .34475 .11704 .60669 .0026 .0011 .0125 .0002 .0014 -.0012
	O7 .33937 0 .28157 .0034 .0008 .0178 0 .0014 0
	SiT1 .28114 .08547 .30202 .75 .0016 .0004 .0055 -.0001 .0007 -.0001
	AlT1 .28114 .08547 .30202 .25 .0016 .0004 .0055 -.0001 .0007 -.0001
	SiT2 .29095 .17237 .81012 .75 .0016 .0005 .0054 -.0001 .0007 .0001
	AlT2 .29095 .17237 .81012 .25 .0016 .0005 .0054 -.0001 .0007 .0001
	AlM1 0 .08724 .5 .11 .0024 .0010 .0060 0 .0016 0
	FeM1 0 .08724 .5 .45 .0024 .0010 .0060 0 .0016 0
	TiM1 0 .08724 .5 .13 .0024 .0010 .0060 0 .0016 0
	MgM1 0 .08724 .5 .31 .0024 .0010 .0060 0 .0016 0
	AlM2 0 .17833 0 .11 .0018 .0005 .0062 0 .0012 0
	FeM2 0 .17833 0 .45 .0018 .0005 .0062 0 .0012 0
	TiM2 0 .17833 0 .13 .0018 .0005 .0062 0 .0012 0
	MgM2 0 .17833 0 .31 .0018 .0005 .0062 0 .0012 0
	AlM3 0 0 0 .11 .0023 .0003 .0058 0 .0004 0
	FeM3 0 0 0 .45 .0023 .0003 .0058 0 .0004 0
	TiM3 0 0 0 .13 .0023 .0003 .0058 0 .0004 0
	MgM3 0 0 0 .31 .0023 .0003 .0058 0 .0004 0
	MgM4 0 .27896 .5 .00 .0030 .0006 .0099 0 .0033 0
	FeM4 0 .27896 .5 .10 .0030 .0006 .0099 0 .0033 0
	CaM4 0 .27896 .5 .84 .0030 .0006 .0099 0 .0033 0
	NaM4 0 .27896 .5 .06 .0030 .0006 .0099 0 .0033 0
	NaA 0 .5 0 .23 .0179 .0027 .0614 0 .0303 0
	KA 0 .5 0 .11 .0179 .0027 .0614 0 .0303 0
	NaAM .04644 .5 .09553 .23 .0144 .0015 .0384 0 .0187 0
	KAM .04644 .5 .09553 .11 .0144 .0015 .0384 0 .0187 0
	NaA2 0 .46667 0 .23 .0060 .0005 .0454 0 .0119 0
	KA2 0 .46667 0 .11 .0060 .0005 .0454 0 .0119 0
	H .19431 0 .79745 1.0000
	MgM42 0 .25860 .5 .00 1.1868
	FeM42 0 .25860 .5 .10 1.1868
	CaM42 0 .25860 .5 .84 1.1868
	NaM42 0 .25860 .5 .06 1.1868
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 15
	_database_code_amcsd 0002365
	9.862 18.067 5.316 90 105.11 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10709 .08832 .21710 .0019 .0010 .0086 -.0002 .0009 -.0001
	O2 .11949 .17289 .73021 .0021 .0008 .0096 .0000 .0006 .0004
	O3 .10840 0 .71185 .0022 .0011 .0125 0 .0007 0
	F3 .10840 0 .71185 .52 .0022 .0011 .0125 0 .0007 0
	Oh3 .10840 0 .71185 .02 .0022 .0011 .0125 0 .0007 0
	O4 .36697 .24995 .78800 .46 .0039 .0007 .0113 -.0004 .0022 .0002
	O5 .34990 .13886 .10732 .0023 .0011 .0104 .0001 .0007 .0013
	O6 .34515 .11732 .60605 .0024 .0011 .0118 .0002 .0008 -.0013
	O7 .33996 0 .28132 .0035 .0009 .0172 0 .0015 0
	SiT1 .28171 .08554 .30191 .73 .0014 .0004 .0052 -.0001 .0004 -.0001
	AlT1 .28171 .08554 .30191 .27 .0014 .0004 .0052 -.0001 .0004 -.0001
	SiT2 .29120 .17249 .81011 .73 .0016 .0005 .0053 -.0001 .0007 .0001
	AlT2 .29120 .17249 .81011 .27 .0016 .0005 .0053 -.0001 .0007 .0001
	AlM1 0 .08636 .5 .09 .0024 .0012 .0062 0 .0017 0
	FeM1 0 .08636 .5 .36 .0024 .0012 .0062 0 .0017 0
	TiM1 0 .08636 .5 .13 .0024 .0012 .0062 0 .0017 0
	MgM1 0 .08636 .5 .42 .0024 .0012 .0062 0 .0017 0
	AlM2 0 .17807 0 .09 .0018 .0005 .0065 0 .0009 0
	FeM2 0 .17807 0 .36 .0018 .0005 .0065 0 .0009 0
	TiM2 0 .17807 0 .13 .0018 .0005 .0065 0 .0009 0
	MgM2 0 .17807 0 .42 .0018 .0005 .0065 0 .0009 0
	AlM3 0 0 0 .09 .0023 .0004 .0055 0 .0001 0
	FeM3 0 0 0 .36 .0023 .0004 .0055 0 .0001 0
	TiM3 0 0 0 .13 .0023 .0004 .0055 0 .0001 0
	MgM3 0 0 0 .42 .0023 .0004 .0055 0 .0001 0
	MgM4 0 .27873 .5 .00 .0029 .0007 .0096 0 .0031 0
	FeM4 0 .27873 .5 .12 .0029 .0007 .0096 0 .0031 0
	CaM4 0 .27873 .5 .82 .0029 .0007 .0096 0 .0031 0
	NaM4 0 .27873 .5 .06 .0029 .0007 .0096 0 .0031 0
	NaA 0 .5 0 .23 .0170 .0006 .0620 0 .0316 0
	KA 0 .5 0 .10 .0170 .0006 .0620 0 .0316 0
	NaAM .05435 .5 .10581 .23 .0140 .0011 .0387 0 .0169 0
	KAM .05435 .5 .10581 .10 .0140 .0011 .0387 0 .0169 0
	NaA2 0 .47483 0 .24 .0162 .0015 .0735 0 .0292 0
	KA2 0 .47483 0 .10 .0162 .0015 .0735 0 .0292 0
	H .19702 0 .76330 1.0000
	MgM42 0 .25899 .5 .00 1.4853
	FeM42 0 .25899 .5 .12 1.4853
	CaM42 0 .25899 .5 .82 1.4853
	NaM42 0 .25899 .5 .06 1.4853
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 16
	_database_code_amcsd 0002366
	9.871 18.028 5.307 90 105.24 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10731 .08762 .21791 .0018 .0008 .0087 -.0001 .0009 -.0003
	O2 .11880 .17228 .73048 .0020 .0007 .0081 .0000 .0006 .0002
	O3 .10772 0 .71366 .46 .0022 .0010 .0101 0 .0011 0
	Oh3 .10772 0 .71366 .54 .0022 .0010 .0101 0 .0011 0
	O4 .36646 .25006 .78859 .0038 .0007 .0083 -.0004 .0010 .0001
	O5 .35002 .13943 .10895 .0023 .0011 .0122 .0000 .0013 .0015
	O6 .34519 .11651 .60970 .0026 .0011 .0124 .0001 .0008 -.0015
	O7 .34053 0 .27894 .0029 .0009 .0200 0 .0023 0
	SiT1 .28171 .08540 .30318 .74 .0013 .0004 .0051 -.0001 .0004 -.0001
	AlT1 .28171 .08540 .30318 .26 .0013 .0004 .0051 -.0001 .0004 -.0001
	SiT2 .29059 .17257 .81130 .74 .0015 .0004 .0058 -.0001 .0008 .0001
	AlT2 .29059 .17257 .81130 .26 .0015 .0004 .0058 -.0001 .0008 .0001
	AlM1 0 .08615 .5 .08 .0022 .0012 .0073 0 .0019 0
	FeM1 0 .08615 .5 .18 .0022 .0012 .0073 0 .0019 0
	TiM1 0 .08615 .5 .14 .0022 .0012 .0073 0 .0019 0
	MgM1 0 .08615 .5 .60 .0022 .0012 .0073 0 .0019 0
	AlM2 0 .17764 0 .08 .0015 .0004 .0052 0 .0009 0
	FeM2 0 .17764 0 .18 .0015 .0004 .0052 0 .0009 0
	TiM2 0 .17764 0 .14 .0015 .0004 .0052 0 .0009 0
	MgM2 0 .17764 0 .60 .0015 .0004 .0052 0 .0009 0
	AlM3 0 0 0 .08 .0026 .0004 .0058 0 .0003 0
	FeM3 0 0 0 .18 .0026 .0004 .0058 0 .0003 0
	TiM3 0 0 0 .14 .0026 .0004 .0058 0 .0003 0
	MgM3 0 0 0 .60 .0026 .0004 .0058 0 .0003 0
	MgM4 0 .27938 .5 .05 .0027 .0005 .0095 0 .0032 0
	FeM4 0 .27938 .5 .04 .0027 .0005 .0095 0 .0032 0
	CaM4 0 .27938 .5 .86 .0027 .0005 .0095 0 .0032 0
	NaM4 0 .27938 .5 .05 .0027 .0005 .0095 0 .0032 0
	NaA 0 .5 0 .24 .0135 .0005 .0703 0 .0291 0
	KA 0 .5 0 .09 .0135 .0005 .0703 0 .0291 0
	NaAM .05018 .5 .09409 .24 .0127 .0014 .0477 0 .0177 0
	KAM .05018 .5 .09409 .09 .0127 .0014 .0477 0 .0177 0
	NaA2 0 .47293 0 .24 .0115 .0014 .0465 0 .0188 0
	KA2 0 .47293 0 .10 .0115 .0014 .0465 0 .0188 0
	H .21087 0 .91256 1.0000
	MgM42 0 .26147 .5 .05 .9043
	FeM42 0 .26147 .5 .04 .9043
	CaM42 0 .26147 .5 .86 .9043
	NaM42 0 .26147 .5 .05 .9043
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 17
	_database_code_amcsd 0002367
	9.888 18.023 5.308 90 105.31 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10701 .08711 .21878 .0023 .0008 .0068 -.0001 .0008 -.0002
	O2 .11813 .17201 .73074 .0020 .0007 .0080 .0000 .0005 .0002
	O3 .10721 0 .71450 .57 .0019 .0009 .0111 0 .0002 0
	Oh3 .10721 0 .71450 .43 .0019 .0009 .0111 0 .0002 0
	O4 .36603 .25044 .78816 .0037 .0007 .0092 -.0002 .0017 .0002
	O5 .34991 .13977 .11237 .0026 .0011 .0103 .0000 .0008 .0012
	O6 .34493 .11601 .61101 .0027 .0011 .0116 .0001 .0010 -.0013
	O7 .34066 0 .27862 .0032 .0008 .0173 0 .0014 0
	SiT1 .28147 .08538 .30404 .74 .0016 .0004 .0052 -.0001 .0005 -.0001
	AlT1 .28147 .08538 .30404 .26 .0016 .0004 .0052 -.0001 .0005 -.0001
	SiT2 .29037 .17270 .81256 .74 .0014 .0004 .0049 -.0001 .0005 .0001
	AlT2 .29037 .17270 .81256 .26 .0014 .0004 .0049 -.0001 .0005 .0001
	AlM1 0 .08631 .5 .09 .0024 .0012 .0057 0 .0016 0
	FeM1 0 .08631 .5 .08 .0024 .0012 .0057 0 .0016 0
	TiM1 0 .08631 .5 .13 .0024 .0012 .0057 0 .0016 0
	MgM1 0 .08631 .5 .70 .0024 .0012 .0057 0 .0016 0
	AlM2 0 .17744 0 .09 .0018 .0005 .0056 0 .0009 0
	FeM2 0 .17744 0 .08 .0018 .0005 .0056 0 .0009 0
	TiM2 0 .17744 0 .13 .0018 .0005 .0056 0 .0009 0
	MgM2 0 .17744 0 .70 .0018 .0005 .0056 0 .0009 0
	AlM3 0 0 0 .09 .0025 .0004 .0069 0 .0001 0
	FeM3 0 0 0 .08 .0025 .0004 .0069 0 .0001 0
	TiM3 0 0 0 .13 .0025 .0004 .0069 0 .0001 0
	MgM3 0 0 0 .70 .0025 .0004 .0069 0 .0001 0
	MgM4 0 .27931 .5 .05 .0030 .0006 .0090 0 .0028 0
	FeM4 0 .27931 .5 .03 .0030 .0006 .0090 0 .0028 0
	CaM4 0 .27931 .5 .86 .0030 .0006 .0090 0 .0028 0
	NaM4 0 .27931 .5 .06 .0030 .0006 .0090 0 .0028 0
	NaA 0 .5 0 .26 .0079 .0022 .0262 0 .0120 0
	KA 0 .5 0 .07 .0079 .0022 .0262 0 .0120 0
	NaAM .04618 .5 .09495 .26 .0092 .0019 .0259 0 .0111 0
	KAM .04618 .5 .09495 .07 .0092 .0019 .0259 0 .0111 0
	NaA2 0 .46915 0 .27 .0079 .0012 .0411 0 .0121 0
	KA2 0 .46915 0 .07 .0079 .0012 .0411 0 .0121 0
	H .19220 0 .79000 .5500
	MgM42 0 .25436 .5 .05 1.3263
	FeM42 0 .25436 .5 .03 1.3263
	CaM42 0 .25436 .5 .86 1.3263
	NaM42 0 .25436 .5 .06 1.3263
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 18
	_database_code_amcsd 0002368
	9.903 18.000 5.304 90 105.44 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10687 .08686 .21900 .0017 .0007 .0074 -.0002 .0007 -.0001
	O2 .11809 .17208 .73087 .0018 .0007 .0078 .0000 .0010 .0002
	O3 .10702 0 .71606 .30 .0019 .0007 .0101 0 .0010 0
	F3 .10702 0 .71606 .01 .0019 .0007 .0101 0 .0010 0
	Oh3 .10702 0 .71606 .69 .0019 .0007 .0101 0 .0010 0
	O4 .36601 .25041 .78847 .0033 .0007 .0092 -.0002 .0021 .0000
	O5 .34956 .14012 .11485 .0023 .0010 .0103 .0000 .0010 .0011
	O6 .34451 .11543 .61274 .0021 .0011 .0116 .0001 .0008 -.0013
	O7 .34026 0 .27738 .0028 .0008 .0171 0 .0014 0
	SiT1 .28091 .08533 .30487 .73 .0013 .0004 .0054 -.0001 .0006 -.0001
	AlT1 .28091 .08533 .30487 .27 .0013 .0004 .0054 -.0001 .0006 -.0001
	SiT2 .29005 .17273 .81334 .73 .0012 .0004 .0047 -.0001 .0006 .0000
	AlT2 .29005 .17273 .81334 .27 .0012 .0004 .0047 -.0001 .0006 .0000
	AlM1 0 .08684 .5 .10 .0022 .0010 .0062 0 .0016 0
	TiM1 0 .08684 .5 .13 .0022 .0010 .0062 0 .0016 0
	MgM1 0 .08684 .5 .77 .0022 .0010 .0062 0 .0016 0
	AlM2 0 .17703 0 .10 .0017 .0005 .0059 0 .0010 0
	TiM2 0 .17703 0 .13 .0017 .0005 .0059 0 .0010 0
	MgM2 0 .17703 0 .77 .0017 .0005 .0059 0 .0010 0
	AlM3 0 0 0 .10 .0023 .0004 .0069 0 -.0001 0
	TiM3 0 0 0 .13 .0023 .0004 .0069 0 -.0001 0
	MgM3 0 0 0 .77 .0023 .0004 .0069 0 -.0001 0
	MgM4 0 .27956 .5 .06 .0027 .0006 .0085 0 .0025 0
	CaM4 0 .27956 .5 .90 .0027 .0006 .0085 0 .0025 0
	NaM4 0 .27956 .5 .04 .0027 .0006 .0085 0 .0025 0
	NaA 0 .5 0 .27 .0046 .0024 .0175 0 .0055 0
	KA 0 .5 0 .07 .0046 .0024 .0175 0 .0055 0
	NaAM .04190 .5 .08869 .27 .0068 .0022 .0216 0 .0085 0
	KAM .04190 .5 .08869 .07 .0068 .0022 .0216 0 .0085 0
	NaA2 0 .46894 0 .26 .0060 .0016 .0343 0 .0098 0
	KA2 0 .46894 0 .06 .0060 .0016 .0343 0 .0098 0
	H .20378 0 .78892 .7037
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 19
	_database_code_amcsd 0002369
	9.906 18.015 5.296 90 105.35 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10755 .08639 .21985 .0018 .0007 .0065 -.0001 .0007 -.0001
	O2 .11847 .17186 .72938 .0018 .0007 .0078 .0000 .0006 .0002
	O3 .10710 0 .71630 .34 .0020 .0007 .0106 0 .0012 0
	F3 .10710 0 .71630 .01 .0020 .0007 .0106 0 .0012 0
	Oh3 .10710 0 .71630 .65 .0020 .0007 .0106 0 .0012 0
	O4 .36550 .24993 .78790 .0031 .0007 .0102 -.0002 .0019 .0001
	O5 .34924 .13956 .11223 .0023 .0011 .0099 .0000 .0010 .0010
	O6 .34450 .11559 .61098 .0022 .0011 .0119 .0002 .0010 -.0013
	O7 .34033 0 .27764 .0026 .0009 .0172 0 .0011 0
	SiT1 .28071 .08517 .30385 .77 .0015 .0004 .0055 -.0001 .0006 -.0001
	AlT1 .28071 .08517 .30385 .23 .0015 .0004 .0055 -.0001 .0006 -.0001
	SiT2 .28975 .17255 .81191 .77 .0014 .0004 .0052 -.0001 .0009 -.0001
	AlT2 .28975 .17255 .81191 .23 .0014 .0004 .0052 -.0001 .0009 -.0001
	AlM1 0 .08687 .5 .09 .0023 .0010 .0064 0 .0020 0
	TiM1 0 .08687 .5 .11 .0023 .0010 .0064 0 .0020 0
	MgM1 0 .08687 .5 .80 .0023 .0010 .0064 0 .0020 0
	AlM2 0 .17689 0 .09 .0018 .0005 .0061 0 .0010 0
	TiM2 0 .17689 0 .11 .0018 .0005 .0061 0 .0010 0
	MgM2 0 .17689 0 .80 .0018 .0005 .0061 0 .0010 0
	AlM3 0 0 0 .09 .0021 .0005 .0071 0 -.0002 0
	TiM3 0 0 0 .11 .0021 .0005 .0071 0 -.0002 0
	MgM3 0 0 0 .80 .0021 .0005 .0071 0 -.0002 0
	MgM4 0 .27912 .5 .07 .0027 .0006 .0088 0 .0028 0
	CaM4 0 .27912 .5 .87 .0027 .0006 .0088 0 .0028 0
	NaM4 0 .27912 .5 .06 .0027 .0006 .0088 0 .0028 0
	NaA 0 .5 0 .27 .0053 .0026 .0163 0 .0060 0
	KA 0 .5 0 .06 .0053 .0026 .0163 0 .0060 0
	NaAM .04027 .5 .08619 .27 .0065 .0025 .0193 0 .0076 0
	KAM .04027 .5 .08619 .06 .0065 .0025 .0193 0 .0076 0
	NaA2 0 .46714 0 .27 .0059 .0013 .0319 0 .0075 0
	KA2 0 .46714 0 .06 .0059 .0013 .0319 0 .0075 0
	H .21016 0 .77040 .8272
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 20
	_database_code_amcsd 0002370
	9.919 18.080 5.313 90 105.26 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10718 .08752 .21812 .0020 .0008 .0073 -.0002 .0007 -.0001
	O2 .11968 .17295 .72901 .0019 .0007 .0078 .0000 .0005 .0004
	O3 .10822 0 .71412 .38 .0021 .0009 .0108 0 .0007 0
	Oh3 .10822 0 .71412 .62 .0021 .0009 .0108 0 .0007 0
	O4 .36643 .24930 .78772 .0035 .0007 .0100 -.0004 .0018 .0002
	O5 .34879 .13904 .10970 .0023 .0010 .0093 .0000 .0005 .0011
	O6 .34432 .11611 .60852 .0024 .0011 .0109 .0002 .0010 -.0012
	O7 .33878 0 .28034 .0031 .0009 .0166 0 .0011 0
	SiT1 .28040 .08531 .30291 .75 .0014 .0004 .0047 -.0001 .0004 -.0001
	AlT1 .28040 .08531 .30291 .25 .0014 .0004 .0047 -.0001 .0004 -.0001
	SiT2 .29033 .17242 .81090 .75 .0014 .0004 .0046 -.0001 .0006 .0001
	AlT2 .29033 .17242 .81090 .25 .0014 .0004 .0046 -.0001 .0006 .0001
	AlM1 0 .08761 .5 .08 .0024 .0009 .0058 0 .0016 0
	FeM1 0 .08761 .5 .28 .0024 .0009 .0058 0 .0016 0
	TiM1 0 .08761 .5 .09 .0024 .0009 .0058 0 .0016 0
	MgM1 0 .08761 .5 .55 .0024 .0009 .0058 0 .0016 0
	AlM2 0 .17773 0 .08 .0017 .0004 .0052 0 .0009 0
	FeM2 0 .17773 0 .28 .0017 .0004 .0052 0 .0009 0
	TiM2 0 .17773 0 .09 .0017 .0004 .0052 0 .0009 0
	MgM2 0 .17773 0 .55 .0017 .0004 .0052 0 .0009 0
	AlM3 0 0 0 .08 .0021 .0004 .0054 0 .0002 0
	FeM3 0 0 0 .28 .0021 .0004 .0054 0 .0002 0
	TiM3 0 0 0 .09 .0021 .0004 .0054 0 .0002 0
	MgM3 0 0 0 .55 .0021 .0004 .0054 0 .0002 0
	MgM4 0 .27911 .5 .04 .0028 .0006 .0085 0 .0029 0
	FeM4 0 .27911 .5 .06 .0028 .0006 .0085 0 .0029 0
	CaM4 0 .27911 .5 .89 .0028 .0006 .0085 0 .0029 0
	NaM4 0 .27911 .5 .01 .0028 .0006 .0085 0 .0029 0
	NaA 0 .5 0 .22 .0062 .0023 .0251 0 .0110 0
	KA 0 .5 0 .12 .0062 .0023 .0251 0 .0110 0
	NaAM .03490 .5 .07303 .22 .0182 .0018 .0556 0 .0257 0
	KAM .03490 .5 .07303 .11 .0182 .0018 .0556 0 .0257 0
	NaA2 0 .46921 0 .22 .0057 .0012 .0391 0 .0118 0
	KA2 0 .46921 0 .11 .0057 .0012 .0391 0 .0118 0
	H .19581 0 .76144 1.0000
	MgM42 0 .25656 .5 .04 1.1665
	FeM42 0 .25656 .5 .06 1.1665
	CaM42 0 .25656 .5 .89 1.1665
	NaM42 0 .25656 .5 .01 1.1665
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 21
	_database_code_amcsd 0002371
	9.869 18.049 5.310 90 105.16 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .10738 .08778 .21719 .0020 .0009 .0078 -.0002 .0012 -.0001
	O2 .11942 .17272 .73024 .0022 .0008 .0083 .0000 .0005 .0005
	O3 .10794 0 .71318 .42 .0022 .0010 .0122 0 .0007 0
	Oh3 .10794 0 .71318 .58 .0022 .0010 .0122 0 .0007 0
	O4 .36678 .24982 .78738 .0039 .0007 .0105 -.0003 .0021 .0004
	O5 .35008 .13952 .10896 .0023 .0010 .0101 .0000 .0008 .0011
	O6 .34452 .11631 .60791 .0026 .0011 .0125 .0002 .0011 -.0011
	O7 .34076 0 .27778 .0035 .0008 .0166 0 .0012 0
	SiT1 .28168 .08542 .30222 .74 .0015 .0004 .0051 -.0001 .0005 -.0001
	AlT1 .28168 .08542 .30222 .26 .0015 .0004 .0051 -.0001 .0005 -.0001
	SiT2 .29103 .17242 .81084 .74 .0015 .0005 .0046 -.0001 .0007 .0001
	AlT2 .29103 .17242 .81084 .26 .0015 .0005 .0046 -.0001 .0007 .0001
	AlM1 0 .08710 .5 .10 .0023 .0010 .0055 0 .0016 0
	FeM1 0 .08710 .5 .61 .0023 .0010 .0055 0 .0016 0
	TiM1 0 .08710 .5 .11 .0023 .0010 .0055 0 .0016 0
	MgM1 0 .08710 .5 .08 .0023 .0010 .0055 0 .0016 0
	AlM2 0 .17793 0 .10 .0019 .0005 .0063 0 .0011 0
	FeM2 0 .17793 0 .61 .0019 .0005 .0063 0 .0011 0
	TiM2 0 .17793 0 .11 .0019 .0005 .0063 0 .0011 0
	MgM2 0 .17793 0 .08 .0019 .0005 .0063 0 .0011 0
	AlM3 0 0 0 .10 .0023 .0004 .0054 0 .0002 0
	FeM3 0 0 0 .61 .0023 .0004 .0054 0 .0002 0
	TiM3 0 0 0 .11 .0023 .0004 .0054 0 .0002 0
	MgM3 0 0 0 .08 .0023 .0004 .0054 0 .0002 0
	MgM4 0 .27915 .5 .02 .0029 .0006 .0091 0 .0030 0
	FeM4 0 .27915 .5 .09 .0029 .0006 .0091 0 .0030 0
	CaM4 0 .27915 .5 .84 .0029 .0006 .0091 0 .0030 0
	NaM4 0 .27915 .5 .05 .0029 .0006 .0091 0 .0030 0
	NaA 0 .5 0 .28 .0080 .0049 .0486 0 .0185 0
	KA 0 .5 0 .06 .0080 .0049 .0486 0 .0185 0
	NaAM .04659 .5 .08963 .27 .0171 .0023 .0608 0 .0245 0
	KAM .04659 .5 .08963 .06 .0171 .0023 .0608 0 .0245 0
	NaA2 0 .46818 0 .27 .0080 .0012 .0527 0 .0128 0
	KA2 0 .46818 0 .06 .0080 .0012 .0527 0 .0128 0
	H .19202 0 .74648 1.0000
	MgM42 0 .25869 .5 .02 .8093
	FeM42 0 .25869 .5 .09 .8093
	CaM42 0 .25869 .5 .84 .8093
	NaM42 0 .25869 .5 .05 .8093
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Oberti R, Vannucci R, Zanetti A, Tiepolo M, Brumm R C
	American Mineralogist 85 (2000) 407-419
	A Crystal Chemical re-evaluation of amphibole/melt and amphibole/clinopyroxene
	DTi values in petrogenetic studies
	SAMPLE 22
	_database_code_amcsd 0002372
	10.032 18.032 5.284 90 104.85 90 C2/m
	atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
	O1 .11010 .08673 .21867 .0015 .0004 .0042 -.0001 .0006 -.0001
	O2 .11827 .17075 .72568 .0020 .0006 .0034 -.0001 .0007 -.0003
	O3 .10632 0 .71530 .05 .0020 .0006 .0057 0 .0012 0
	Oh3 .10632 0 .71530 .95 .0020 .0006 .0057 0 .0012 0
	O4 .36244 .24766 .79739 .0038 .0006 .0063 -.0006 .0017 -.0005
	O5 .34302 .13060 .09776 .0023 .0008 .0099 .0000 .0018 .0009
	O6 .33931 .11654 .59360 .0021 .0009 .0063 .0002 .0004 -.0012
	O7 .33118 0 .29933 .0027 .0003 .0112 0 .0017 0
	SiT1 .27466 .08516 .30046 .96 .0016 .0003 .0042 .0000 .0007 -.0001
	AlT1 .27466 .08516 .30046 .02 .0016 .0003 .0042 .0000 .0007 -.0001
	TiT1 .27466 .08516 .30046 .02 .0016 .0003 .0042 .0000 .0007 -.0001
	SiT2 .28480 .17170 .80593 .96 .0016 .0003 .0041 -.0001 .0006 .0000
	AlT2 .28480 .17170 .80593 .02 .0016 .0003 .0041 -.0001 .0006 .0000
	TiT2 .28480 .17170 .80593 .02 .0016 .0003 .0041 -.0001 .0006 .0000
	FeM1 0 .08837 .5 .09 .0020 .0006 .0043 0 .0012 0
	TiM1 0 .08837 .5 .02 .0020 .0006 .0043 0 .0012 0
	MgM1 0 .08837 .5 .89 .0020 .0006 .0043 0 .0012 0
	FeM2 0 .17962 0 .09 .0021 .0004 .0058 0 .0013 0
	TiM2 0 .17962 0 .02 .0021 .0004 .0058 0 .0013 0
	MgM2 0 .17962 0 .89 .0021 .0004 .0058 0 .0013 0
	FeM3 0 0 0 .09 .0023 .0003 .0049 0 .0012 0
	TiM3 0 0 0 .02 .0023 .0003 .0049 0 .0012 0
	MgM3 0 0 0 .89 .0023 .0003 .0049 0 .0012 0
	CaM4 0 .27775 .5 .54 .0035 .0005 .0105 0 .0038 0
	NaM4 0 .27775 .5 .46 .0035 .0005 .0105 0 .0038 0
	NaA 0 .5 0 .05 .0010 .0021 .0127 0 .0035 0
	KA 0 .5 0 .41 .0010 .0021 .0127 0 .0035 0
	NaAM .02267 .5 .05059 .05 .0086 .0013 .0281 0 .0095 0
	KAM .02267 .5 .05059 .41 .0086 .0013 .0281 0 .0095 0
	H .19780 0 .75713 1.0000
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Halenius U, Bosi F
	American Mineralogist 97 (2012) 1635-1640
	Cation ordering in Pb2+-bearing, Mn3+-rich pargasite from Langban, Sweden
	Locality: Langban, Sweden
	_database_code_amcsd 0019530
	9.9448 18.0171 5.2829 90 105.445 90 C2/m
	atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	NaA2 0 .47416 0 .90 .0639 .0289 .048 .124 0 .038 0
	Pb2+A2 0 .47416 0 .067 .0639 .0289 .048 .124 0 .038 0
	KA2 0 .47416 0 .03 .0639 .0289 .048 .124 0 .038 0
	MgM1 0 .08888 .5 .91 .0062 .0075 .0063 .0053 0 .0023 0
	Mn3+M1 0 .08888 .5 .055 .0062 .0075 .0063 .0053 0 .0023 0
	Fe3+M1 0 .08888 .5 .025 .0062 .0075 .0063 .0053 0 .0023 0
	AlM1 0 .08888 .5 .01 .0062 .0075 .0063 .0053 0 .0023 0
	MgM2 0 .17595 0 .805 .0051 .0056 .0051 .0049 0 .0018 0
	Mn3+M2 0 .17595 0 .14 .0051 .0056 .0051 .0049 0 .0018 0
	AlM2 0 .17595 0 .055 .0051 .0056 .0051 .0049 0 .0018 0
	MgM3 0 0 0 .81 .0058 .0067 .0056 .0050 0 .0017 0
	Mn3+M3 0 0 0 .04 .0058 .0067 .0056 .0050 0 .0017 0
	AlM3 0 0 0 .14 .0058 .0067 .0056 .0050 0 .0017 0
	CaM4 0 .27952 .5 .965 .00906 .0113 .0074 .0101 0 .00564 0
	Mn2+M4' 0 .2628 .5 .07 .011
	SiT1 .27974 .08489 .30315 .593 .00699 .0066 .0071 .0071 -.00048 .00154 -.00030
	AlT1 .27974 .08489 .30315 .407 .00699 .0066 .0071 .0071 -.00048 .00154 -.00030
	SiT2 .28968 .17254 .81127 .00629 .0061 .00688 .00595 -.00047 .00168 .00010
	O1 .10767 .08634 .21947 .0091 .0078 .0108 .0084 -.0010 .0017 .0002
	O2 .12024 .17250 .72790 .0076 .0057 .0091 .0079 .0002 .0014 .0003
	O3 .10770 0 .71802 .0089 .0069 .0095 .0102 0 .0019 0
	O4 .36588 .24907 .78694 .0101 .0115 .0085 .0109 -.0026 .0041 -.0004
	O5 .34870 .13969 .11256 .0114 .0093 .0150 .0089 -.0004 .0004 .0048
	O6 .34450 .11446 .61330 .0118 .0088 .0139 .0129 .0008 .0029 -.0051
	O7 .34069 0 .2734 .0132 .0094 .0129 .0169 0 .0029 0
	H3 .210 0 .766 .013
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	Pargasite
	Jenkins D M, Hawthorne F C
	The Canadian Mineralogist 33 (1995) 13-24
	Synthesis and rietveld refinement of amphibole along
	the join Ca2Mg5Si8O22F2 - NaCa2Mg4Ga3Si6O22F2
	Sample: PARG 10-1
	Locality: Synthetic
	_database_code_amcsd 0005420
	9.8356 18.025 5.2801 90 104.793 90 C2/m
	atom x y z occ Biso
	SiT1 .2847 .0846 .3026 .89 .4
	GaT1 .2847 .0846 .3026 .11 .4
	SiT2 .2893 .1709 .8044 .98 .4
	GaT2 .2893 .1709 .8044 .02 .4
	MgM1 0 .0871 .5 .6
	MgM2 0 .1775 0 .92 .6
	GaM2 0 .1775 0 .08 .6
	MgM3 0 0 0 .6
	CaM4 0 .2773 .5 .96 .9
	MgM4 0 .2773 .5 .04 .9
	NaA 0 .5 0 .27 2.3
	O1 .1143 .0849 .2123 .8
	O2 .1164 .1698 .7231 .8
	F3 .1001 0 .7105 .8
	O4 .3570 .2457 .7822 .8
	O5 .3474 .1338 .0933 1.0
	O6 .3451 .1166 .5963 1.0
	O7 .3451 0 .2899 1.2
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	Pargasite
	Jenkins D M, Hawthorne F C
	The Canadian Mineralogist 33 (1995) 13-24
	Synthesis and rietveld refinement of amphibole along
	the join Ca2Mg5Si8O22F2 - NaCa2Mg4Ga3Si6O22F2
	Sample: PARG 9-1
	Locality: Synthetic
	_database_code_amcsd 0005421
	9.8620 18.025 5.2930 90 104.924 90 C2/m
	atom x y z occ Biso
	SiT1 .2857 .0847 .3056 .81 .4
	GaT1 .2857 .0847 .3056 .19 .4
	SiT2 .2898 .1699 .8065 .95 .4
	GaT2 .2898 .1699 .8065 .05 .4
	MgM1 0 .0858 .5 .98 .6
	MgM2 0 .1786 0 .84 .6
	GaM2 0 .1786 0 .16 .6
	MgM3 0 0 0 .98 .6
	CaM4 0 .2784 .5 .90 .9
	MgM4 0 .2784 .5 .10 .9
	NaA 0 .5 0 .46 2.3
	O1 .1135 .0867 .2164 .8
	O2 .1102 .1735 .7288 .8
	F3 .1027 0 .7125 .8
	O4 .3519 .2479 .7776 .8
	O5 .3516 .1370 .0886 1.0
	O6 .3456 .1155 .6055 1.0
	O7 .3483 0 .2935 1.2
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	Pargasite
	Jenkins D M, Hawthorne F C
	The Canadian Mineralogist 33 (1995) 13-24
	Synthesis and rietveld refinement of amphibole along
	the join Ca2Mg5Si8O22F2 - NaCa2Mg4Ga3Si6O22F2
	Sample: PARG 8-2
	Locality: Synthetic
	_database_code_amcsd 0005422
	9.8820 18.017 5.2990 90 105.068 90 C2/m
	atom x y z occ Biso
	SiT1 .2835 .0848 .3027 .74 .4
	GaT1 .2835 .0848 .3027 .26 .4
	SiT2 .2897 .1711 .8139 .96 .4
	GaT2 .2897 .1711 .8139 .04 .4
	MgM1 0 .0862 .5 .6
	MgM2 0 .1781 0 .79 .6
	GaM2 0 .1781 0 .21 .6
	MgM3 0 0 0 .98 .6
	CaM4 0 .2785 .5 .98 .9
	MgM4 0 .2785 .5 .02 .9
	NaA 0 .5 0 .71 2.3
	O1 .1108 .0879 .2033 .8
	O2 .1126 .1717 .7326 .8
	F3 .1026 0 .7083 .8
	O4 .3516 .2470 .7749 .8
	O5 .3552 .1384 .0935 1.0
	O6 .3397 .1155 .6192 1.0
	O7 .3517 0 .2901 1.2
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	Pargasite
	Jenkins D M, Hawthorne F C
	The Canadian Mineralogist 33 (1995) 13-24
	Synthesis and rietveld refinement of amphibole along
	the join Ca2Mg5Si8O22F2 - NaCa2Mg4Ga3Si6O22F2
	Sample: PARG 7-1
	Locality: Synthetic
	_database_code_amcsd 0005423
	9.897 18.010 5.3059 90 105.165 90 C2/m
	atom x y z occ Biso
	SiT1 .2836 .0853 .3044 .67 .4
	GaT1 .2836 .0853 .3044 .33 .4
	SiT2 .2906 .1720 .8166 .90 .4
	GaT2 .2906 .1720 .8166 .10 .4
	MgM1 0 .0860 .5 .6
	MgM2 0 .1786 0 .68 .6
	GaM2 0 .1786 0 .32 .6
	MgM3 0 0 0 .97 .6
	CaM4 0 .2789 .5 .89 .9
	MgM4 0 .2789 .5 .12 .9
	NaA 0 .5 0 .80 2.3
	O1 .1092 .0873 .2066 .8
	O2 .1132 .1723 .7295 .8
	F3 .1036 0 .7232 .8
	O4 .3554 .2477 .7868 .8
	O5 .3541 .1395 .1080 1.0
	O6 .3423 .1148 .6284 1.0
	O7 .3455 0 .2637 1.2
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	Pargasite
	Jenkins D M, Hawthorne F C
	The Canadian Mineralogist 33 (1995) 13-24
	Synthesis and rietveld refinement of amphibole along
	the join Ca2Mg5Si8O22F2 - NaCa2Mg4Ga3Si6O22F2
	Sample: PARG 6-4
	Locality: Synthetic
	_database_code_amcsd 0005424
	9.8992 17.992 5.3081 90 105.190 90 C2/m
	atom x y z occ Biso
	SiT1 .2829 .0849 .3065 .68 .4
	GaT1 .2829 .0849 .3065 .32 .4
	SiT2 .2889 .1724 .8127 .90 .4
	GaT2 .2889 .1724 .8127 .10 .4
	MgM1 0 .0854 .5 .98 .6
	MgM2 0 .1783 0 .63 .6
	GaM2 0 .1783 0 .37 .6
	MgM3 0 0 0 .98 .6
	CaM4 0 .2799 .5 .86 .9
	MgM4 0 .2799 .5 .14 .9
	NaA 0 .5 0 .86 2.3
	O1 .1127 .0902 .2099 .8
	O2 .1062 .1716 .7263 .8
	F3 .1005 0 .7283 .8
	O4 .3524 .2462 .7795 .8
	O5 .3552 .1389 .1015 1.0
	O6 .3419 .1129 .6166 1.0
	O7 .3530 0 .2676 1.2
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	Pargasite
	Oberti R, Hawthorne F C, Ungaretti L, Cannillo E
	The Canadian Mineralogist 33 (1995) 867-878
	[6]Al disorder in amphiboles from mantle peridotites
	Sample: F11
	_database_code_amcsd 0005455
	9.857 17.932 5.285 90 105.36 90 C2/m
	atom x y z occ Biso
	SiT1 .2807 .0854 .3031 .761 .46
	AlT1 .2807 .0854 .3031 .239 .46
	SiT2 .2910 .1734 .8139 .761 .50
	AlT2 .2910 .1734 .8139 .239 .50
	MgM1 0 .0894 .5 .93 .53
	FeM1 0 .0894 .5 .07 .53
	CrM2 0 .1762 0 .02 .54
	AlM2 0 .1762 0 .31 .54
	FeM2 0 .1762 0 .05 .54
	MgM2 0 .1762 0 .62 .54
	AlM3 0 0 0 .28 .50
	MgM3 0 0 0 .64 .50
	FeM3 0 0 0 .08 .50
	FeM4 0 .2796 .5 .08 .77
	MgM4 0 .2796 .5 .02 .77
	CaM4 0 .2796 .5 .90 .77
	FeM4' 0 .2543 .5 .08 .87
	MgM4' 0 .2543 .5 .02 .87
	CaM4' 0 .2543 .5 .92 .87
	NaA 0 .5 0 .187 2.36
	KA 0 .5 0 .003 2.36
	NaA(m) .0254 .5 .0801 .187 5.31
	KA(m) .0254 .5 .0801 .003 5.31
	NaA(2) 0 .4683 0 .186 1.26
	KA(2) 0 .4683 0 .002 1.26
	H .1855 0 .7555 2.69
	O1 .1059 .0875 .2144 .92
	O2 .1197 .1736 .7347 .69
	Oh3 .1074 0 .7183 .85
	O4 .3679 .2505 .7871 .92
	O5 .3507 .1416 .1146 .88
	O6 .3433 .1152 .6146 1.05
	O7 .3410 0 .2694 1.09
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	Pargasite
	Oberti R, Hawthorne F C, Ungaretti L, Cannillo E
	The Canadian Mineralogist 33 (1995) 867-878
	[6]Al disorder in amphiboles from mantle peridotites
	Sample: F12
	_database_code_amcsd 0005456
	9.854 17.935 5.285 90 105.31 90 C2/m
	atom x y z occ Biso
	SiT1 .2807 .0854 .3030 .762 .43
	AlT1 .2807 .0854 .3030 .238 .43
	SiT2 .2910 .1734 .8139 .762 .45
	AlT2 .2910 .1734 .8139 .238 .45
	MgM1 0 .0894 .5 .92 .50
	FeM1 0 .0894 .5 .08 .50
	CrM2 0 .1762 0 .02 .47
	AlM2 0 .1762 0 .32 .47
	FeM2 0 .1762 0 .04 .47
	MgM2 0 .1762 0 .62 .47
	AlM3 0 0 0 .27 .48
	MgM3 0 0 0 .65 .48
	FeM3 0 0 0 .08 .48
	FeM4 0 .2800 .5 .03 .62
	MgM4 0 .2800 .5 .02 .62
	CaM4 0 .2800 .5 .45 .62
	FeM4' 0 .2586 .5 .03 .80
	MgM4' 0 .2586 .5 .02 .80
	CaM4' 0 .2586 .5 .45 .80
	NaA 0 .5 0 .183 5.72
	KA 0 .5 0 .002 5.72
	NaA(m) .0169 .5 .0583 .183 3.78
	KA(m) .0169 .5 .0583 .002 3.78
	NaA(2) 0 .4696 0 .183 1.82
	KA(2) 0 .4696 0 .002 1.82
	H .1926 0 .7648 2.27
	O1 .1060 .0875 .2146 .90
	O2 .1196 .1736 .7346 .66
	Oh3 .1076 0 .7189 .83
	O4 .3677 .2505 .7875 .88
	O5 .3507 .1417 .1151 .86
	O6 .3434 .1153 .6143 1.02
	O7 .3410 0 .2694 1.04
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	Pargasite
	Oberti R, Hawthorne F C, Ungaretti L, Cannillo E
	The Canadian Mineralogist 33 (1995) 867-878
	[6]Al disorder in amphiboles from mantle peridotites
	Sample: F14
	_database_code_amcsd 0005458
	9.855 17.927 5.283 90 105.44 90 C2/m
	atom x y z occ Biso
	SiT1 .2808 .0854 .3033 .759 .46
	AlT1 .2808 .0854 .3033 .241 .46
	SiT2 .2910 .1734 .8141 .759 .49
	AlT2 .2910 .1734 .8141 .241 .49
	MgM1 0 .0894 .5 .92 .51
	FeM1 0 .0894 .5 .08 .51
	CrM2 0 .1761 0 .01 .50
	AlM2 0 .1761 0 .32 .50
	FeM2 0 .1761 0 .06 .50
	MgM2 0 .1761 0 .61 .50
	AlM3 0 0 0 .27 .48
	MgM3 0 0 0 .66 .48
	FeM3 0 0 0 .07 .48
	FeM4 0 .2796 .5 .03 .73
	MgM4 0 .2796 .5 .02 .73
	CaM4 0 .2796 .5 .45 .73
	FeM4' 0 .2544 .5 .03 .89
	MgM4' 0 .2544 .5 .02 .89
	CaM4' 0 .2544 .5 .45 .89
	NaA 0 .5 0 .187 1.86
	KA 0 .5 0 .001 1.86
	NaA(m) .0264 .5 .0833 .187 2.93
	KA(m) .0264 .5 .0833 .002 2.93
	NaA(2) 0 .4678 0 .187 1.25
	KA(2) 0 .4678 0 .001 1.25
	H .1835 0 .7725 2.05
	O1 .1059 .0874 .2145 .91
	O2 .1197 .1736 .7345 .68
	Oh3 .1073 0 .7188 .86
	O4 .3680 .2505 .7868 .94
	O5 .3507 .1419 .1153 .86
	O6 .3431 .1151 .6149 1.04
	O7 .3412 0 .2692 1.05
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	Pargasite
	Oberti R, Hawthorne F C, Ungaretti L, Cannillo E
	The Canadian Mineralogist 33 (1995) 867-878
	[6]Al disorder in amphiboles from mantle peridotites
	Sample: F15
	_database_code_amcsd 0005459
	9.854 17.931 5.282 90 105.33 90 C2/m
	atom x y z occ Biso
	SiT1 .2808 .0854 .3031 .762 .43
	AlT1 .2808 .0854 .3031 .238 .43
	SiT2 .2911 .1734 .8139 .762 .46
	AlT2 .2911 .1734 .8139 .238 .46
	MgM1 0 .0894 .5 .92 .50
	FeM1 0 .0894 .5 .08 .50
	CrM2 0 .1762 0 .02 .47
	AlM2 0 .1762 0 .30 .47
	FeM2 0 .1762 0 .04 .47
	MgM2 0 .1762 0 .64 .47
	AlM3 0 0 0 .32 .46
	MgM3 0 0 0 .61 .46
	FeM3 0 0 0 .07 .46
	FeM4 0 .2801 .5 .03 .61
	MgM4 0 .2801 .5 .02 .61
	CaM4 0 .2801 .5 .44 .61
	NaM4 0 .2801 .5 .01 .61
	FeM4' 0 .2592 .5 .03 .71
	MgM4' 0 .2592 .5 .02 .71
	CaM4' 0 .2592 .5 .44 .71
	NaM4' 0 .2592 .5 .01 .71
	NaA 0 .5 0 .182 6.39
	KA 0 .5 0 .002 6.39
	NaA(m) .0232 .5 .0501 .181 5.80
	KA(m) .0232 .5 .0501 .002 5.80
	NaA(2) 0 .4691 0 .182 1.32
	KA(2) 0 .4691 0 .002 1.32
	H .1893 0 .7677 1.67
	O1 .1062 .0873 .2148 .89
	O2 .1197 .1736 .7344 .67
	Oh3 .1074 0 .7195 .82
	O4 .3677 .2505 .7870 .88
	O5 .3507 .1419 .1153 .86
	O6 .3434 .1150 .6148 1.02
	O7 .3412 0 .2686 1.04
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	Pargasite
	Hawthorne F C, Oberti R, Sardone N
	The Canadian Mineralogist 34 (1996) 577-593
	Sodium at the A site in clinoamphiboles: the effects of composition
	on patterns of order
	Sample: A9 - BM47 N.1
	_database_code_amcsd 0005494
	9.870 17.991 5.291 90 105.08 90 C2/m
	atom x y z occ Biso
	SiT1 .2808 .0854 .3017 .81 .46
	AlT1 .2808 .0854 .3017 .19 .46
	SiT2 .2902 .1725 .8096 .52
	MgM1 0 .0876 .5 .82 .68
	FeM1 0 .0876 .5 .13 .68
	TiM1 0 .0876 .5 .05 .68
	AlM2 0 .1773 0 .12 .57
	CrM2 0 .1773 0 .14 .57
	FeM2 0 .1773 0 .07 .57
	MgM2 0 .1773 0 .67 .57
	MgM3 0 0 0 .71 .56
	FeM3 0 0 0 .17 .56
	AlM3 0 0 0 .12 .56
	FeM4 0 .2784 .5 .04 .83
	CaM4 0 .2784 .5 .37 .83
	NaM4 0 .2784 .5 .09 .83
	FeM4' 0 .2532 .5 .04 1.08
	CaM4' 0 .2532 .5 .37 1.08
	NaM4' 0 .2532 .5 .09 1.08
	NaAm .0326 .5 .0697 .160 3.45
	KAm .0326 .5 .0697 .038 3.45
	NaA2 0 .4758 0 .220 3.40
	KA2 0 .4758 0 .050 3.40
	H .1860 0 .7687 .97 .79
	O1 .1076 .0869 .2183 .74
	O2 .1193 .1719 .7297 .73
	Oh3 .1074 0 .7151 .97 .84
	F3 .1074 0 .7151 .03 .84
	O4 .3660 .2497 .7871 1.05
	O5 .3493 .1387 .1078 1.04
	O6 .3442 .1155 .6080 1.08
	O7 .3403 0 .2769 1.21
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	Pargasite
	Hawthorne F C, Oberti R, Sardone N
	The Canadian Mineralogist 34 (1996) 577-593
	Sodium at the A site in clinoamphiboles: the effects of composition
	on patterns of order
	Sample: A10 - FE129 N.1
	_database_code_amcsd 0005495
	9.839 17.963 5.291 90 105.17 90 C2/m
	atom x y z occ Biso
	SiT1 .2807 .0855 .3023 .77 .43
	AlT1 .2807 .0855 .3023 .23 .43
	SiT2 .2914 .1733 .8135 .49
	MgM1 0 .0894 .5 .87 .53
	FeM1 0 .0894 .5 .13 .53
	AlM2 0 .1764 0 .40 .50
	TiM2 0 .1764 0 .01 .50
	FeM2 0 .1764 0 .11 .50
	MgM2 0 .1764 0 .48 .50
	MgM3 0 0 0 .71 .51
	FeM3 0 0 0 .16 .51
	AlM3 0 0 0 .13 .51
	FeM4 0 .2803 .5 .05 .65
	CaM4 0 .2803 .5 .44 .65
	NaM4 0 .2803 .5 .01 .65
	CaM4' 0 .2599 .5 .05 .80
	NaM4' 0 .2599 .5 .44 .80
	FeM4' 0 .2599 .5 .01 .80
	NaAm .0221 .5 .0585 .071 2.54
	KAm .0221 .5 .0585 .002 2.54
	NaA2 0 .4730 0 .324 2.65
	KA2 0 .4730 0 .007 2.65
	H .1922 0 .7658 .50
	O1 .1064 .0884 .2146 .89
	O2 .1198 .1740 .7350 .70
	Oh3 .1086 0 .7169 .80
	O4 .3684 .2505 .7885 .94
	O5 .3508 .1413 .1137 .90
	O6 .3435 .1161 .6112 1.05
	O7 .3397 0 .2714 1.13
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	Pargasite
	Hawthorne F C, Oberti R, Sardone N
	The Canadian Mineralogist 34 (1996) 577-593
	Sodium at the A site in clinoamphiboles: the effects of composition
	on patterns of order
	Sample: A11 - FE229 N.18
	_database_code_amcsd 0005496
	9.854 17.931 5.282 90 105.33 90 C2/m
	atom x y z occ Biso
	SiT1 .2808 .0854 .3031 .76 .43
	AlT1 .2808 .0854 .3031 .24 .43
	SiT2 .2911 .1734 .8139 .46
	MgM1 0 .0894 .5 .92 .50
	FeM1 0 .0894 .5 .08 .50
	AlM2 0 .1762 0 .31 .47
	TiM2 0 .1762 0 .01 .47
	CrM2 0 .1762 0 .02 .47
	FeM2 0 .1762 0 .04 .47
	MgM2 0 .1762 0 .62 .47
	MgM3 0 0 0 .61 .46
	FeM3 0 0 0 .07 .46
	AlM3 0 0 0 .32 .46
	FeM4 0 .2801 .5 .05 .61
	CaM4 0 .2801 .5 .45 .61
	NaM4 0 .2801 .5 .01 .61
	FeM4' 0 .2594 .5 .04 .74
	CaM4' 0 .2594 .5 .44 .74
	NaM4' 0 .2594 .5 .01 .74
	NaAm .0168 .5 .0413 .171 4.37
	KAm .0168 .5 .0413 .002 4.37
	NaA2 0 .4703 0 .281 2.09
	KA2 0 .4703 0 .003 2.09
	H .1900 0 .7689 .98 1.79
	O1 .1062 .0873 .2148 .89
	O2 .1197 .1736 .7344 .67
	Oh3 .1074 0 .7195 .98 .82
	F3 .1074 0 .7195 .02 .82
	O4 .3677 .2505 .7870 .88
	O5 .3507 .1419 .1153 .85
	O6 .3434 .1150 .6148 1.02
	O7 .3413 0 .2686 1.04
	Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink)
	Pargasite
	Hawthorne F C, Oberti R, Sardone N
	The Canadian Mineralogist 34 (1996) 577-593
	Sodium at the A site in clinoamphiboles: the effects of composition
	on patterns of order
	Sample: A12 - KP N.1
	_database_code_amcsd 0005497
	9.862 17.928 5.295 90 105.28 90 C2/m
	atom x y z occ Biso
	SiT1 .2800 .0859 .3032 .76 .49
	AlT1 .2800 .0859 .3032 .24 .49
	SiT2 .2907 .1737 .8147 .49
	MgM1 0 .0900 .5 .84 .53
	FeM1 0 .0900 .5 .16 .53
	AlM2 0 .1770 0 .54 .50
	FeM2 0 .1770 0 .06 .50
	MgM2 0 .1770 0 .40 .50
	MgM3 0 0 0 .75 .49
	FeM3 0 0 0 .25 .49
	CaM4 0 .2803 .5 .88 .72
	NaM4 0 .2803 .5 .12 .72
	NaAm .0100 .5 .0191 .124 4.16
	KAm .0100 .5 .0191 .005 4.16
	NaA2 0 .4706 0 .358 2.42
	KA2 0 .4706 0 .014 2.42
	H .2102 0 .7705 .98 5.80
	O1 .1054 .0888 .2142 .98
	O2 .1195 .1736 .7365 .76
	Oh3 .1080 0 .7155 .98 .88
	F3 .1080 0 .7155 .02 .88
	O4 .3672 .2509 .7900 .85
	O5 .3510 .1408 .1129 .91
	O6 .3430 .1159 .6140 1.00
	O7 .3396 0 .2725 1.11
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	Pargasite
	Oberti R, Hawthorne F C, Camara F, Raudsepp M
	The Canadian Mineralogist 36 (1998) 1245-1252
	Synthetic fluoro-amphiboles: site preferences of Al, Ga, Sc and inductive
	effects on mean bond-lengths of octahedra
	Sample: A4
	_database_code_amcsd 0005571
	9.850 17.934 5.301 90 105.32 90 C2/m
	atom x y z occ Biso
	SiT1 .2824 .0851 .3054 .75 .42
	AlT1 .2824 .0851 .3054 .18 .42
	GaT1 .2824 .0851 .3054 .07 .42
	SiT2 .2911 .1733 .8153 .75 .51
	AlT2 .2911 .1733 .8153 .18 .51
	GaT2 .2911 .1733 .8153 .07 .51
	MgM1 0 .0892 .5 .82 .44
	AlM1 0 .0892 .5 .09 .44
	GaM1 0 .0892 .5 .09 .44
	MgM2 0 .1757 0 .82 .44
	AlM2 0 .1757 0 .09 .44
	GaM2 0 .1757 0 .09 .44
	MgM3 0 0 0 .82 .41
	AlM3 0 0 0 .09 .41
	GaM3 0 0 0 .09 .41
	CaM4 0 .2794 .5 .76
	NaA 0 .5 0 .10 2.19
	CaA 0 .5 0 .01 2.19
	NaAm .0398 .5 .0914 .38 2.35
	CaAm .0398 .5 .0914 .05 2.35
	NaA2 0 .4717 0 .38 2.07
	CaA2 0 .4717 0 .05 2.07
	O1 .1072 .0868 .2177 .66
	O2 .1185 .1718 .7345 .62
	F3 .1035 0 .7127 .77
	O4 .3668 .2514 .7879 .86
	O5 .3522 .1409 .1160 1.02
	O6 .3463 .1161 .6131 1.04
	O7 .3451 0 .2766 1.05
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	Pargasite
	Tait K T, Hawthorne F C, Della Ventura G
	The Canadian Mineralogist 39 (2001) 1725-1732
	Al-Mg disorder in a gem-quality pargasite from Baffin Island, Nunavut, Canada
	Locality: Baffin Island, Nunavut, Canada
	_database_code_amcsd 0005759
	9.8814 17.967 5.2927 90 105.263 90 C2/m
	atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
	O(1) .1066 .0873 .2167 .0111 .0083 .0162 .0090 -.0019 .0026 -.0010
	O(2) .1192 .1724 .7319 .0094 .0056 .0118 .0101 .0000 .0008 .0009
	O(3) .1068 0 .7159 .0077 .0057 .0081 .0089 0 .0011 0
	O(4) .3663 1/4 .7903 .0114 .0123 .0099 .0129 -.0019 .0050 -.0002
	O(5) .3505 .1393 .1104 .0125 .0086 .0168 .0108 -.0005 .0004 .0045
	O(6) .3447 .1169 .6098 .0127 .0091 .0150 .0135 .0001 .0021 -.0046
	O(7) .3418 0 .2823 .0149 .0127 .0120 .0191 0 .0026 0
	Si(1) .27988 .08548 .3030 .81 .0087 .0086 .0087 .0084 -.0009 .0016 -.0001
	Al(1) .27988 .08548 .3030 .19 .0087 .0086 .0087 .0084 -.0009 .0016 -.0001
	Si(2) .29017 .17327 .8125 .0072 .0071 .0076 .0069 -.0002 .0021 -.0004
	Mg(1) 0 .08891 1/2 .97 .0082 .0085 .0097 .0064 0 .0023 0
	Ti(1) 0 .08891 1/2 .03 .0082 .0085 .0097 .0064 0 .0023 0
	Mg(2) 0 .17617 0 .70 .0051 .0057 .0050 .0048 0 .0018 0
	Al(2) 0 .17617 0 .27 .0051 .0057 .0050 .0048 0 .0018 0
	Fe(2) 0 .17617 0 .03 .0051 .0057 .0050 .0048 0 .0018 0
	Mg(3) 0 0 0 .81 .0065 .0071 .0064 .0053 0 .0004 0
	Al(3) 0 0 0 .17 .0065 .0071 .0064 .0053 0 .0004 0
	Fe(3) 0 0 0 .02 .0065 .0071 .0064 .0053 0 .0004 0
	Ca(4) 0 .27942 1/2 .91 .0101 .0117 .0095 .0107 0 .0057 0
	Na(4) 0 .27942 1/2 .09 .0101 .0117 .0095 .0107 0 .0057 0
	NaA(2) 0 .471 0 .62 .0200
	KA(m) .045 1/2 .095 .24 .0200
	NaA(m) .045 1/2 .095 .11 .0200
	H(1) .200 0 .832 .02
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	Pargasite
	Comodi P, Mellini M, Ungaretti L, Zanazzi P F
	European Journal of Mineralogy 3 (1991) 485-499
	Compressibility and high pressure structure refinement
	of tremolite, pargasite and glaucophane
	Sample: pressure at ambient conditions (.001 kbar)
	_database_code_amcsd 0006418
	9.881 17.998 5.284 90 105.25 90 C2/m
	atom x y z occ Uiso
	NaA 0 1/2 0 .26 .040
	NaAM .0460 1/2 .1297 .12 .043
	NaA2 0 .4666 0 .12 .025
	KA2 0 .4666 0 .01 .025
	MgM1 0 .0888 1/2 .945 .0058
	FeM1 0 .0888 1/2 .055 .0058
	MgM2 0 .1761 0 .725 .0045
	AlM2 0 .1761 0 .15 .0045
	CrM2 0 .1761 0 .09 .0045
	TiM2 0 .1761 0 .035 .0045
	MgM3 0 0 0 .92 .0046
	FeM3 0 0 0 .08 .0046
	CaM4 0 .2791 1/2 .49 .0096
	FeM4 0 .2791 1/2 .01 .0096
	CaM42 .4653 .2198 .6168 .25 .045
	SiT1 .2797 .0850 .3022 .655 .0052
	AlT1 .2797 .0850 .3022 .345 .0052
	SiT2 .2899 .1726 .8112 .0056
	O1 .1077 .0873 .2185 .0088
	O2 .1193 .1729 .7306 .0089
	O3 .1077 0 .7152 .0103
	O4 .3664 .2494 .7887 .0102
	O5 .3484 .1390 .1096 .0112
	O6 .3436 .1164 .6064 .0125
	O7 .3382 0 .2795 .0132
	H .175 0 .748 .012
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	Pargasite
	Comodi P, Mellini M, Ungaretti L, Zanazzi P F
	European Journal of Mineralogy 3 (1991) 485-499
	Compressibility and high pressure structure refinement
	of tremolite, pargasite and glaucophane
	Sample: pressure at 35 kbar
	_database_code_amcsd 0006419
	9.733 17.828 5.240 90 105.6 90 C2/m
	atom x y z occ Uiso
	NaA 0 1/2 0 .74 .076
	KA 0 1/2 0 .02 .076
	MgM1 0 .0884 1/2 .945 .0076
	FeM1 0 .0884 1/2 .055 .0076
	MgM2 0 .1749 0 .725 .0081
	AlM2 0 .1749 0 .15 .0081
	CrM2 0 .1749 0 .09 .0081
	TiM2 0 .1749 0 .035 .0081
	MgM3 0 0 0 .92 .0072
	FeM3 0 0 0 .08 .0072
	CaM4 0 .2786 1/2 .099 .0075
	FeM4 0 .2786 1/2 .01 .0075
	SiT1 .2813 .0847 .3058 .655 .0054
	AlT1 .2813 .0847 .3058 .345 .0054
	SiT2 .2859 .1728 .8113 .0049
	O1 .1068 .0869 .2170 .0081
	O2 .1125 .1716 .7314 .0139
	OH3 .1124 0 .7163 .0120
	O4 .3689 .2508 .7860 .0104
	O5 .3544 .1413 .1204 .0129
	O6 .3461 .1151 .6160 .0137
	O7 .3487 0 .2796 .0122
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	Pargasite
	Oberti R, Ungaretti L, Cannillo E, Hawthorne F C, Memmi I
	European Journal of Mineralogy 7 (1995) 1049-1063
	Temperature-dependent Al order-disorder in the
	tetrahedral double chain of C2/m amphiboles
	Sample: S(5)
	_database_code_amcsd 0006603
	9.869 18.058 5.320 90 105.03 90 C2/m
	atom x y z occ Biso
	NaA 0 1/2 0 .078 3.54
	KA 0 1/2 0 .02 3.54
	NaAm .0362 1/2 .0719 .078 4.89
	KAm .0362 1/2 .0719 .02 4.89
	NaA2 0 .4670 0 .078 1.90
	KA2 0 .4670 0 .02 1.90
	FeM1 0 .0888 1/2 .31 .57
	MgM1 0 .0888 1/2 .69 .57
	AlM2 0 .1779 0 .15 .52
	TiM2 0 .1779 0 .105 .52
	FeM2 0 .1779 0 .245 .52
	MgM2 0 .1779 0 .5 .52
	AlM3 0 0 0 .05 .51
	FeM3 0 0 0 .35 .51
	MgM3 0 0 0 .6 .51
	CaM4 0 .2798 1/2 .4625 .83
	NaM4 0 .2798 1/2 .01 .83
	MnM4 0 .2798 1/2 .005 .83
	FeM4 0 .2798 1/2 .0225 .83
	CaM4' 0 .2541 1/2 .4625 .70
	NaM4' 0 .2541 1/2 .01 .70
	MnM4' 0 .2541 1/2 .005 .70
	FeM4' 0 .2541 1/2 .0225 .70
	SiT1 .2806 .0852 .3007 .9475 .44
	AlT1 .2806 .0852 .3007 .0525 .44
	SiT2 .2906 .1721 .8111 .925 .48
	AlT2 .2906 .1721 .8111 .075 .48
	H .1903 0 .7648 .979 2.94
	O1 .1080 .0888 .2152 .73
	O2 .1187 .1738 .7327 .71
	O3 .1095 0 .7141 .979 .79
	F3 .1095 0 .7141 .021 .79
	O4 .3685 .2496 .7906 .93
	O5 .3492 .1386 .1095 .96
	O6 .3429 .1177 .6012 1.00
	O7 .3360 0 .2821 1.14
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	Pargasite
	Oberti R, Ungaretti L, Cannillo E, Hawthorne F C, Memmi I
	European Journal of Mineralogy 7 (1995) 1049-1063
	Temperature-dependent Al order-disorder in the
	tetrahedral double chain of C2/m amphiboles
	Sample: S(6)
	Note: O(5) y-coordinate changed to reproduce reported bond lengths
	_database_code_amcsd 0006604
	9.867 18.044 5.318 90 105.06 90 C2/m
	atom x y z occ Biso
	NaA 0 1/2 0 .09 5.76
	KA 0 1/2 0 .02 5.76
	NaAm .0341 1/2 .0664 .09 3.97
	KAm .0341 1/2 .0664 .02 3.97
	NaA2 0 .4664 0 .09 5.09
	KA2 0 .4664 0 .02 5.09
	MgM1 0 .0889 1/2 .69 .63
	FeM1 0 .0889 1/2 .31 .63
	MgM2 0 .1779 0 .49 .58
	AlM2 0 .1779 0 .16 .58
	TiM2 0 .1779 0 .105 .58
	FeM2 0 .1779 0 .235 .58
	NiM2 0 .1779 0 .005 .58
	ZnM2 0 .1779 0 .005 .58
	MgM3 0 0 0 .61 .55
	AlM3 0 0 0 .05 .55
	FeM3 0 0 0 .34 .55
	CaM4 0 .2799 1/2 .46 .90
	MnM4 0 .2799 1/2 .005 .90
	FeM4 0 .2799 1/2 .035 .90
	CaM4' 0 .2526 1/2 .46 .76
	MnM4' 0 .2526 1/2 .005 .76
	FeM4' 0 .2526 1/2 .035 .76
	AlT1 .2806 .0853 .3011 .05 .48
	SiT1 .2806 .0853 .3011 .95 .48
	AlT2 .2907 .1721 .8116 .10 .52
	SiT2 .2907 .1721 .8116 .90 .52
	H .1897 0 .7511 .986 2.51
	O1 .1079 .0889 .2147 .77
	O2 .1186 .1740 .7330 .73
	O3 .1093 0 .7143 .986 .81
	F3 .1093 0 .7143 .014 .81
	O4 .3687 .2497 .7905 .97
	O5 .3492 .1386 .1104 1.00
	O6 .3428 .1176 .6017 1.03
	O7 .3358 0 .2819 1.20
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	Pargasite
	Oberti R, Ungaretti L, Cannillo E, Hawthorne F C, Memmi I
	European Journal of Mineralogy 7 (1995) 1049-1063
	Temperature-dependent Al order-disorder in the
	tetrahedral double chain of C2/m amphiboles
	Sample: S(7)
	_database_code_amcsd 0006605
	9.870 18.046 5.318 90 105.04 90 C2/m
	atom x y z occ Biso
	NaA 0 1/2 0 .092 3.03
	KA 0 1/2 0 .02 3.03
	NaAm .0408 1/2 .0875 .092 4.20
	KAm .0408 1/2 .0875 .02 4.20
	NaA2 0 .491 0 .092 2.79
	KA2 0 .491 0 .02 2.79
	MgM1 0 .0887 1/2 .71 .60
	FeM1 0 .0887 1/2 .29 .60
	MgM2 0 .1778 0 .505 .54
	AlM2 0 .1778 0 .125 .54
	TiM2 0 .1778 0 .165 .54
	FeM2 0 .1778 0 .205 .54
	MgM3 0 0 0 .63 .54
	AlM3 0 0 0 .05 .54
	FeM3 0 0 0 .32 .54
	NaM4 0 .2803 1/2 .0025 .74
	CaM4 0 .2803 1/2 .4575 .74
	MnM4 0 .2803 1/2 .005 .74
	FeM4 0 .2803 1/2 .035 .74
	NaM4' 0 .2580 1/2 .0025 .62
	CaM4' 0 .2580 1/2 .4575 .62
	MnM4' 0 .2580 1/2 .005 .62
	FeM4' 0 .2580 1/2 .035 .62
	AlT1 .2807 .0853 .3011 .065 .47
	SiT1 .2807 .0853 .3011 .935 .47
	AlT2 .2907 .1722 .8114 .1075 .50
	SiT2 .2907 .1722 .8114 .8925 .50
	H .2003 0 .7683 .979 1.53
	O1 .1080 .0886 .2154 .72
	O2 .1186 .1738 .7329 .72
	O3 .1094 0 .7144 .979 .81
	F3 .1094 0 .7144 .021 .81
	O4 .3684 .2498 .7903 .94
	O5 .3493 .1389 .1102 1.00
	O6 .3431 .1174 .6022 1.03
	O7 .3368 0 .2812 1.19
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	Pargasite
	Welch M D, Knight K S
	European Journal of Mineralogy 11 (1999) 321-331
	A neutron powder diffraction study of cation ordering in
	high-temperature synthetic amphiboles
	_database_code_amcsd 0006771
	9.8930 17.937 5.2802 90 105.518 90 C2/m
	atom x y z occ Uiso
	NaA2/m 0 .5 0 .068
	MgM1 0 .0881 .5 .0057
	MgM2 0 .1761 0 .75 .0011
	AlM2 0 .1761 0 .25 .0011
	MgM3 0 0 0 .5 .0067
	AlM3 0 0 0 .5 .0067
	CaM4 0 .2804 .5 .0104
	SiT1 .2807 .0861 .3040 .58 .0023
	AlT1 .2807 .0861 .3040 .42 .0023
	SiT2 .2884 .1734 .8171 .92 .0025
	AlT2 .2884 .1734 .8171 .08 .0025
	O1 .1070 .0866 .2185 .0093
	O2 .1199 .1726 .7330 .0078
	O3 .1061 0 .7176 .0010
	O4 .3658 .2506 .7863 .0072
	O5 .3489 .1399 .1165 .0059
	O6 .3436 .1135 .6191 .0089
	O7 .3414 0 .2672 .0083
	H .2045 0 .7796 .045
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