POTASSIUM PERXENATE 9-HYDRATE/A.ZALKIN ET AL /(1964) JACS 86,3569 9.049 10.924 15.606 90. 90. 90. .0 1 0 0 .0 0 1 0 .0 0 0 1 .0 -1 0 0 .0 0 -1 0 .5 0 0 1 .0 -1 0 0 .5 0 1 0 .0 0 0 1 1 .0 1 0 0 .5 0 -1 0 .5 0 0 1 XE .249 .988 .250 .10 7 K1 .628 .987 .339 .30 7 K2 .846 .238 .958 .30 7 K3 .307 .227 .026 .30 7 K4 .877 .989 .139 .30 7 O1 .403 .101 .251 .20 7 O2 .094 .878 .253 .20 7 O3 .138 .096 .316 .20 7 O4 .176 .058 .151 .20 7 O5 .323 .918 .351 .20 7 O6 .360 .881 .188 .20 7 W1 .654 .839 .190 .20 7 W2 .850 .136 .297 .20 7 W3 .873 .829 .369 .20 7 W4 .692 .046 .506 .20 7 W5 .997 .243 .111 .20 7 W6 .967 .980 .972 .20 7 W7 .376 .470 .002 .20 7 W8 .493 .262 .886 .20 7 W9 .606 .150 .124 .20 7 ORGN .250 .500 .400 .10 7 .000 .000 .000 1 .03 7 3 201 ***** INITIALILIZE CRT PLOT ***** 301 4.4 6.0 12 0.50 303 3 401 2255501 -2266601 ***** STORE UNIT CELL CORNERS FOR CELL OUTLINE ***** 3 404 21 21 1 5 .13 .52 .57 ***** STORE CENTRAL ATOMS OF POLYHEDRA **** 3 405 1 5 1 20 3.52 ***** CONVOLUTE SPHERE OF ENCLOSURE WITH EACH CENTRAL ATOM ***** 411 756404 3 501 2155501 2155501 2156501 2155501 2155601 1 ***** B AXIS HORIZONTAL, C AXIS VERTICAL, VIEWED ALONG -A AXIS ***** 3 604 ***** AUTOMATIC SCALE AND POSITION ***** 3 503 2 3 ***** STEREO ROTATION FOR LEFT EYE VIEW ***** 3 601 2.2 ***** SHIFT PICTURE ALONG POSITIVE X 3 1101 ***** START SAVED SEQUENCE ***** 2 1001 1 2 22 22 22 22 1 9.0 11.0 .01 2 22 22 22 22 1 15.0 16.0 .01 2 6 11 6 11 3 2.5 2.8 .04 -1 1 1.8 1.9 2 6 19 6 19 1 2.6 4.4 .02 -2 2 2.6 3.1 2 10 20 10 20 1 2.6 4.7 .02 -3 3 2.7 3.52 2 9 20 9 20 1 2.6 4.58 .02 -4 4 2.7 3.3 7 20 7 20 1 2.6 4.6 .02 -5 5 2.7 3.2 714 1 714 3 1 5 ***** DRAW METAL ATOMS SELECTIVELY ***** 2 812 2 22 22 22 22 1 9.0 11.0 .01 2 22 22 22 22 1 15.0 16.0 .01 2 6 11 6 11 3 2.5 2.8 .04 -1 1 1.8 1.9 2 6 19 6 19 1 2.6 4.4 .02 -2 2 2.6 3.1 2 10 20 10 20 1 2.6 4.7 .02 -3 3 2.7 3.52 2 9 20 9 20 1 2.6 4.58 .02 -4 4 2.7 3.3 3 7 20 7 20 1 2.6 4.6 .02 -5 5 2.7 3.2 ***** DRAW POLYHEDRA AND CELL OUTLINE ***** 3 902 2155501 2.5 0.6 .11 POTASSIUM PERXENATE 9-HYDRATE 3 1102 ***** END SAVED SEQUENCE ***** 3 202 3.6 ***** ADVANCE PLOTTER FOR RIGHT EYE VIEW ***** 3 503 2 -3 ***** STEREO ROTATION FOR RIGHT EYE VIEW ***** 3 1103 ***** REPEAT SAVED SEQUENCE 202 -1