Strontioginorite Grice J D The Canadian Mineralogist 43 (2005) 1019-1026 Strontioginorite: crystal-structure analysis and hydrogen bonding Sample: Penobsquis, Kings County, New Brunswick, Canada _database_code_amcsd 0006023 12.8171 14.4576 12.8008 90 101.327 90 P2_1/a atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Sr .61773 .17104 .73631 .01266 .01255 .01385 .01270 .00081 .00518 .00090 Ca .12691 .21922 .24657 .01271 .0116 .0145 .012 .00047 .00323 -.00020 B1 .3906 .2019 -.1234 .0116 .0103 .0156 .0097 -.0007 .0034 -.0020 B2 .4329 .3028 .0508 .0122 .0108 .0158 .0106 -.0015 .0033 -.0014 B3 .2632 .1964 .0125 .012 .0099 .0156 .0102 -.0011 .0034 -.0016 B4 .5752 .2547 -.0426 .0134 .0113 .0177 .0116 -.0002 .0028 -.0001 B5 .3425 .2579 .1940 .0128 .0117 .0161 .0110 .0007 .0030 -.0004 B6 .3041 .0563 -.0793 .0176 .0180 .0169 .0196 -.0018 .0080 -.0030 B7 .3909 .3198 .3790 .0110 .0103 .0136 .0092 .0005 .0027 .0003 B8 .4231 .2027 .5392 .0112 .0108 .0127 .0107 .0000 .0035 -.0002 B9 .2553 .3107 .5049 .0108 .0091 .0134 .0106 .0004 .0032 -.0002 B10 .5702 .2545 .4567 .0113 .0100 .0128 .0114 -.0002 .0024 -.0013 B11 .3357 .2527 .6870 .0116 .0100 .0142 .0108 -.0013 .0027 -.0006 B12 .2918 .4570 .4154 .0154 .0162 .0146 .0168 .0013 .0063 .0019 B13 .4098 .0662 .4099 .0143 .0162 .0130 .0148 .0006 .0054 -.0007 B14 .5245 .0623 .2736 .0159 .0171 .0148 .0172 .0004 .0068 -.0011 O1 .36670 .23073 -.01619 .0112 .0094 .0149 .0096 -.0016 .0031 -.0021 O2 .43256 .28843 .16350 .0165 .0130 .0273 .0098 -.0054 .0037 -.0028 O3 .26259 .21563 .12386 .0150 .0128 .0258 .0102 -.0040 .0044 -.0036 O4 .25822 .09641 -.00390 .0189 .0224 .0153 .0228 -.0039 .0134 -.0040 O5 .36394 .10376 -.13751 .0170 .0211 .0150 .0176 -.0033 .0106 -.0038 O6 .50382 .21244 -.12115 .0149 .0096 .0231 .0125 -.0018 .0034 -.0036 O7 .54432 .29426 .04367 .0170 .0105 .0266 .0150 -.0032 .0050 -.0070 Oh8 .2939 -.03712 -.1001 .0324 .0475 .0165 .0433 -.0104 .0331 -.0097 Oh9 .38786 .39242 .01462 .0226 .0253 .0149 .0249 .0014 -.0014 -.0012 O10 .17728 .24475 -.05638 .0171 .0098 .0282 .0138 .0014 .0036 .0043 O11 .32221 .26825 .29316 .0140 .0111 .0217 .0097 -.0021 .0030 -.0025 O12 .36268 .28403 .48183 .0102 .0085 .0131 .0096 .0010 .0032 .0011 O13 .41210 .20398 .65046 .0129 .0138 .0155 .0104 .0024 .0050 .0013 O14 .25872 .30099 .61876 .0136 .0118 .0201 .0096 .0029 .0034 .0012 O15 .23477 .40711 .47531 .0144 .0141 .0130 .0179 .0022 .0074 .0017 O16 .36793 .41761 .36912 .0157 .0170 .0138 .0182 .0033 .0084 .0033 O17 .50387 .30540 .38105 .0124 .0090 .0165 .0120 .0007 .0030 .0019 O18 .53563 .21339 .53912 .0127 .0098 .0165 .0124 .0010 .0038 .0024 Oh19 .2709 .5492 .3968 .0285 .0353 .0153 .0426 .0088 .0265 .0092 O20 .38137 .11539 .49021 .0149 .0161 .0139 .0165 -.0021 .0074 -.0028 Oh21 .37338 -.02187 .38927 .0218 .0314 .0154 .0231 -.0072 .0165 -.0053 O22 .47503 .10394 .34641 .0192 .0254 .0137 .0226 -.0034 .0152 -.0036 Oh23 .5035 -.02604 .2416 .0270 .0324 .0156 .0407 -.0065 .0260 -.0095 Oh24 .59516 .11733 .23334 .0220 .0278 .0168 .0264 -.0056 .0179 -.0045 O25 .17299 .25171 .44172 .0130 .0093 .0169 .0133 -.0014 .0035 -.0022 O26 .32821 .25721 .79196 .0149 .0141 .0218 .0095 .0035 .0037 .0008 Ow27 .1091 .1503 .7210 .0305 .0364 .0248 .0320 .0029 .0110 -.0023 Ow28 .1546 .0621 .2712 .0355 .0446 .0242 .0431 .0096 .0218 .0065 Ow29 .2366 .45021 .84915 .0266 .0282 .0267 .0231 .0037 .0009 -.0003 Ow30 .0184 .0384 .8665 .0352 .0398 .0318 .0341 .0028 .0075 .0007 Ow31 .0519 -.0244 .4009 .0363 .0318 .0352 .0432 .0090 .0107 .0071 H8 .256 -.059 -.071 .05 H9 .415 .432 .056 .05 H19 .230 .565 .430 .05 H21 .338 -.038 .432 .05 H23 .551 -.045 .208 .05 H24 .619 .090 .198 .05 H27A .088 .148 .685 .05 H27B .123 .136 .774 .05 H28A .135 .037 .319 .05 H28B .208 .024 .262 .05 H29A .284 .422 .897 .05 H29B .218 .494 .883 .05 H30A -.030 .012 .815 .05 H30B -.025 .065 .908 .05 H31A .022 -.079 .381 .05 H31B -.006 .015 .392 .05