Penobsquisite Grice J D, Gault R A, Van Velthuizen J The Canadian Mineralogist 34 (1996) 657-665 Penobsquisite: A new borate mineral with a complex framework structure _database_code_amcsd 0005500 11.620 9.407 8.726 90 98.58 90 P2_1 atom x y z Uiso Ca1 .63456 .28302 .47322 .0102 Ca2 .65876 .48751 .09093 .0108 Fe .93944 .59614 -.07485 .0134 Cl .98111 0 .29606 .0232 B1 .8966 .3404 .3122 .0106 B2 .6114 .5806 -.3044 .0090 B3 .4616 .7360 .1648 .0106 B4 .1575 .6538 .1801 .0093 B5 .8831 .3442 .0269 .0091 B6 .4685 .2360 .0994 .0110 B7 .0729 .4010 .2008 .0110 B8 .7225 .3678 -.1977 .0083 B9 .5439 .5887 -.5904 .0104 O1 .8288 .3293 .1697 .0108 O2 .0110 .3706 .3326 .0127 OH3 .8380 .3258 .4385 .0174 O4 .6768 .4628 -.3244 .0097 O5 .5551 .6479 -.4319 .0123 O6 .6053 .6277 -.1577 .0151 O7 .5328 .6873 .0640 .0135 O8 .6270 .3244 -.1104 .0111 O9 .5234 .1989 -.3174 .0127 O10 .7679 .2444 -.2691 .0103 O11 .1485 .5218 .2388 .0138 O12 .0984 .6988 .0378 .0113 O13 .8083 .4344 -.0826 .0089 O14 .9917 .4221 .0594 .0097 Oh15 .5863 .2437 .1914 .0173 Oh16 .4213 .3782 .0972 .0308 Oh17 .8560 .7706 -.1776 .0158 Oh18 .6533 .5499 .3554 .0136 Oh19 .4807 .4531 .4003 .0149 OW20 .7105 .0362 .4648 .0222 OW21 .7159 .9951 .1420 .0482 OW22 .8714 .6798 .4426 .0351 OW23 .8311 .6689 .1294 .0265 H3 .882 .347 .520 .0500 H15 .620 .166 .162 .0500 H16 .409 .395 .182 .0500 H17 .199 .283 .186 .0500 H18 .713 .597 .405 .0500 H19 .426 .462 .434 .0500 H20 .768 .037 .547 .0500 H20a .724 .010 .390 .0500 H21 .229 .511 -.131 .0500 H21a .323 .456 -.066 .0500 H22 .088 .121 .497 .0500 H22a .117 .257 .540 .0500 H23 .817 .751 .109 .0500 H23a .861 .678 .222 .0500