Scholzite Taxer K J American Mineralogist 60 (1975) 1019-1022 Structural investigations on scholzite _database_code_amcsd 0000476 17.149 22.236 6.667 90 90 90 *Pbc2_1 .25 -.083333333333 0 atom x y z Biso Ca1 .0157 .1265 .2540 .69 Ca2 -.0067 .2065 .7480 1.04 Ca3 -.0075 .8730 .7580 2.25 Zn1 .2111 .0030 .1955 .46 Zn2 -.2299 -.0029 .3211 .35 Zn3 .2822 .1686 .1941 .81 Zn4 -.2756 .1661 .3195 .72 Zn5 .2674 .8284 .1853 .68 Zn6 -.2108 .3302 -.1884 .71 P1 .1525 .1108 .9300 .34 P2 .8523 .1034 -.4440 .16 P3 .1571 .2284 .4420 .17 P4 .8567 .2254 .0700 .13 P5 .1421 .8939 .4350 .67 P6 -.1577 .8916 .0560 .13 O1 .1551 .0784 .1380 .20 O2 .1568 .0653 .7570 1.03 O3 .2279 .1519 .9520 1.06 O4 .0782 .1483 .9420 .21 O5 -.1546 .0644 -.2460 2.30 O6 -.1584 .0586 .3810 1.02 O7 .7787 .1491 -.4140 .46 O8 .9297 .1356 -.4370 .95 O9 .1642 .2661 .6310 .48 O10 .1586 .2644 .2570 .76 O11 .2283 .1854 .4680 .14 O12 .0814 .1918 .4750 .14 O13 -.1532 .2600 .2570 1.37 O14 -.1462 .2649 -.1180 .49 O15 -.2169 .1811 .0760 .17 O16 -.0650 .1925 .0720 1.03 O17 .1532 .9237 .6370 .49 O18 .1447 .9351 .2600 .19 O19 .2109 .8489 .4380 .59 O20 .0684 .8558 .4540 .35 O21 -.1581 .9361 -.1150 1.69 O22 -.1658 .9253 .2620 .14 O23 -.0841 .8543 -.9240 1.36 O24 -.2341 .8485 -.9250 .14 Wat25 .0497 .0459 .4710 1.35 Wat26 .9453 .0533 .0920 .95 Wat27 .0580 .2857 .9640 2.37 Wat28 .9593 .2906 -.4560 1.98 Wat29 .0355 .9524 .9650 1.66 Wat30 -.0550 .9508 -.4240 1.02