# Strucrue factors of KMnF3 at 190K data_190K loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_meas _refln_F_calc _refln_F_sigma 0 0 1 14.0700 14.0604 .1011 0 1 1 27.0519 27.1609 .1900 1 1 1 13.1753 13.1939 .0959 0 0 2 47.0459 46.7034 .3310 0 1 2 10.9164 10.8336 .0774 1 1 2 22.1947 22.2169 .1562 0 2 2 34.4438 34.6526 .2424 0 0 3 7.5305 7.4720 .0574 1 2 2 8.8767 8.9050 .0632 0 1 3 17.7948 17.6208 .1257 1 1 3 3.9192 3.9207 .0358 2 2 2 27.2942 27.5099 .1927 0 2 3 6.2670 6.3121 .0456 1 2 3 15.7707 15.9342 .1112 0 0 4 23.6397 23.5879 .1699 0 1 4 6.5445 6.5877 .0480 2 2 3 5.4704 5.4530 .0430 1 1 4 15.3508 15.3873 .1084 0 3 3 13.6036 13.6466 .0973 0 2 4 19.9484 20.0424 .1408 1 2 4 5.6689 5.6884 .0426 2 3 3 12.5599 12.6746 .0935 2 2 4 17.3931 17.4654 .1226 0 3 4 4.5087 4.4967 .0362 0 0 5 3.2556 3.3166 .0422 0 1 5 11.2189 11.1476 .0816 1 3 4 12.3529 12.3798 .0897 2 3 4 4.1496 4.1262 .0346 0 2 5 3.1360 3.1567 .0316 1 2 5 10.5008 10.5072 .0760 0 4 4 14.0872 14.0712 .1047 2 2 5 3.0176 3.0474 .0398 1 4 4 4.3732 4.3140 .0408 0 3 5 9.5624 9.5390 .0696 3 3 4 10.3158 10.3622 .0778 2 4 4 12.7817 12.7285 .0961 0 0 6 13.3555 13.2473 .1039 0 1 6 4.4254 4.4010 .0376 1 1 6 10.6885 10.6476 .0806 2 3 5 9.0303 9.0378 .0658 0 2 6 12.0727 12.0217 .0881 3 4 4 3.5847 3.5633 .0414 1 2 6 4.1110 4.1225 .0362 0 4 5 3.0228 2.9855 .0330 1 4 5 8.8330 8.8527 .0644 2 2 6 10.9947 10.9809 .0826 0 3 6 3.7107 3.6863 .0352 2 4 5 2.9349 2.9411 .0334 1 3 6 9.0731 9.0576 .0660 4 4 4 9.8455 9.8558 .0828 2 3 6 3.5347 3.5416 .0344 0 1 7 7.1908 7.1420 .0536 3 4 5 7.7147 7.7247 .0570 0 5 5 7.2845 7.3008 .0576 0 4 6 9.3115 9.3562 .0678 1 4 6 3.6551 3.6184 .0350 1 2 7 6.8584 6.8255 .0516 3 3 6 7.7926 7.8345 .0606 2 5 5 6.9981 6.9648 .0558 2 4 6 8.6928 8.6485 .0634 4 4 5 2.8409 2.8834 .0458 0 3 7 6.3781 6.3863 .0486 0 5 6 2.9943 2.9840 .0354 3 4 6 3.3176 3.2501 .0352 2 3 7 6.1126 6.1123 .0470 1 5 6 6.8317 6.8413 .0514 0 0 8 8.1523 8.0438 .0650 0 4 7 2.4440 2.4023 .0404 2 5 6 2.9453 2.9311 .0360 0 1 8 3.6885 3.7256 .0360 1 4 7 6.0047 5.9601 .0468 1 1 8 7.2749 7.2321 .0574 4 5 5 6.0452 6.0564 .0514 4 4 6 7.0322 6.9766 .0552 0 2 8 7.4445 7.4602 .0554 1 2 8 3.5494 3.5641 .0362 3 5 6 6.0468 6.0489 .0472 0 6 6 6.6530 6.6394 .0542 2 2 8 6.9210 6.9344 .0558 0 3 8 3.3128 3.3453 .0360 1 6 6 3.1652 3.1739 .0458 1 3 8 6.2729 6.3023 .0480 0 5 7 5.2086 5.1860 .0426 3 4 7 5.3859 5.3586 .0438 2 6 6 6.1892 6.1987 .0518 4 5 6 2.7969 2.7871 .0358 2 3 8 3.1974 3.2202 .0356 2 5 7 4.9754 4.9744 .0414 0 4 8 6.0591 6.0526 .0468 4 4 7 2.4286 2.4416 .0502 1 4 8 3.1628 3.1726 .0352 3 6 6 2.9369 2.9182 .0460 3 3 8 5.4795 5.5398 .0488 0 1 9 4.4759 4.4372 .0388 3 5 7 2.0738 2.0579 .0390 2 4 8 5.6515 5.6564 .0446 0 6 7 2.4820 2.4767 .0360 1 6 7 4.7723 4.7709 .0400 5 5 6 4.8045 4.8203 .0458 1 2 9 4.2423 4.2780 .0374 4 6 6 5.0845 5.1165 .0468 2 6 7 2.4464 2.4463 .0354 3 4 8 2.8509 2.9012 .0348 0 5 8 2.8313 2.8118 .0372 2 2 9 2.1255 1.9970 .0506 4 5 7 4.3906 4.3835 .0380 1 5 8 4.8963 4.9007 .0404 0 3 9 4.0745 4.0823 .0366 2 5 8 2.7053 2.7244 .0344 3 6 7 4.3166 4.3054 .0374 2 3 9 3.9670 3.9353 .0358 4 4 8 4.6258 4.6773 .0442 5 6 6 2.5136 2.5339 .0448 1 4 9 3.8171 3.8218 .0348 3 5 8 4.3816 4.3675 .0372 0 7 7 3.9184 3.8840 .0416 1 7 7 2.0652 2.0636 .0488 5 5 7 2.1086 2.1247 .0478 0 6 8 4.4288 4.4532 .0370 0 0 10 4.9334 4.9071 .0480 4 6 7 2.2717 2.3351 .0336 2 4 9 1.9840 2.0461 .0360 1 6 8 2.6292 2.6807 .0328 0 1 10 3.0658 3.0644 .0326 2 7 7 3.7219 3.7322 .0406 1 1 10 4.6754 4.6664 .0426 0 2 10 4.6224 4.5923 .0374 2 6 8 4.1630 4.1894 .0352 4 5 8 2.4802 2.4851 .0318 1 2 10 2.9115 2.9205 .0318 3 4 9 3.4903 3.5131 .0344 0 5 9 3.4597 3.4606 .0342 3 7 7 2.0552 2.0650 .0432 1 5 9 1.9574 1.9373 .0330 2 2 10 4.3096 4.3036 .0418 3 6 8 2.4230 2.4725 .0388 0 3 10 2.8037 2.7694 .0322 5 6 7 3.5939 3.5393 .0312 2 5 9 3.2888 3.3340 .0300 1 3 10 4.0552 4.1147 .0350 0 7 8 2.3303 2.2716 .0402 2 3 10 2.6092 2.6465 .0302 4 4 9 1.9576 2.0130 .0494 1 7 8 3.5253 3.5063 .0312 4 7 7 3.3853 3.3035 .0348 5 5 8 3.4925 3.5207 .0418 4 6 8 3.5309 3.5250 .0304 0 4 10 3.7828 3.8050 .0328 1 4 10 2.5154 2.5500 .0272 3 3 10 3.6207 3.6493 .0338 6 6 7 2.0042 2.1020 .0370 0 1 11 2.5622 2.6611 .0390 4 5 9 2.8835 2.9709 .0272 3 7 8 3.1478 3.1720 .0294 5 7 7 1.9554 1.9752 .0362 0 5 10 2.3832 2.3087 .0318 3 4 10 2.3958 2.3269 .0312 5 6 8 2.1679 2.1346 .0266 1 2 11 2.6335 2.5848 .0286 1 5 10 3.2999 3.2566 .0308 3 6 9 2.9109 2.8837 .0280 0 8 8 3.1146 3.0728 .0404 2 5 10 2.2621 2.2158 .0338 1 8 8 2.1429 2.1427 .0374 4 7 8 2.0546 2.0255 .0272 # Strucrue factors of KMnF3 at 240K data_240K loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_meas _refln_F_calc _refln_F_sigma 0 0 1 14.1821 14.1885 .1014 0 1 1 26.9879 27.0311 .1895 1 1 1 13.2150 13.1225 .0952 0 0 2 46.3141 46.2229 .3252 0 1 2 11.0218 10.9183 .0778 1 1 2 22.1701 21.9834 .1559 0 2 2 33.9370 34.2019 .2384 0 0 3 7.5389 7.4798 .0556 1 2 2 8.9431 8.9888 .0635 0 1 3 17.4712 17.4046 .1234 1 1 3 3.4807 3.5115 .0345 2 2 2 27.0512 27.0448 .1919 0 2 3 6.4796 6.4245 .0472 1 2 3 15.4096 15.4816 .1085 0 0 4 23.0368 22.8660 .1652 0 1 4 6.6911 6.7597 .0486 2 2 3 5.5613 5.5858 .0438 1 1 4 14.8708 15.0111 .1051 0 3 3 13.1181 13.2021 .0950 0 2 4 19.2997 19.3690 .1365 1 2 4 5.7898 5.8234 .0436 2 3 3 12.0282 12.1093 .0903 2 2 4 16.7716 16.7779 .1186 0 0 5 3.4287 3.4781 .0377 0 3 4 4.6826 4.6793 .0373 0 1 5 10.5844 10.6366 .0762 1 3 4 11.6597 11.7746 .0845 2 3 4 4.2854 4.2949 .0349 0 2 5 3.3406 3.3298 .0298 1 2 5 9.8659 9.9029 .0704 0 4 4 13.3744 13.3248 .1004 2 2 5 3.2452 3.2300 .0319 1 4 4 4.4546 4.4271 .0417 0 3 5 8.8321 8.9404 .0637 3 3 4 9.7336 9.6872 .0714 0 0 6 12.6458 12.5165 .0946 2 4 4 12.0101 11.9721 .0905 0 1 6 4.5042 4.5214 .0373 1 1 6 9.9994 9.9554 .0754 2 3 5 8.3987 8.3952 .0613 0 2 6 11.3092 11.2683 .0823 1 2 6 4.2514 4.2161 .0365 3 4 4 3.7251 3.7093 .0409 0 4 5 3.1874 3.1666 .0329 1 4 5 8.1604 8.1505 .0597 2 2 6 10.1983 10.2155 .0766 0 3 6 3.7987 3.7966 .0349 2 4 5 3.1172 3.1171 .0333 1 3 6 8.3064 8.3060 .0609 4 4 4 9.2046 9.0924 .0770 2 3 6 3.7001 3.6359 .0351 0 5 5 6.6708 6.6592 .0532 3 4 5 7.0221 7.0218 .0524 0 1 7 6.5371 6.4446 .0492 0 4 6 8.6136 8.5809 .0627 1 4 6 3.6570 3.6597 .0351 0 2 7 2.2771 2.3422 .0371 3 3 6 7.0267 7.0738 .0559 1 2 7 6.1804 6.1302 .0472 2 5 5 6.2782 6.3062 .0514 2 4 6 7.9053 7.8824 .0583 2 2 7 2.3890 2.4085 .0498 4 4 5 2.9646 3.0141 .0454 0 3 7 5.6971 5.7197 .0446 3 4 6 3.2783 3.2945 .0357 0 5 6 3.0999 3.0608 .0355 2 3 7 5.4311 5.4445 .0436 1 5 6 6.0951 6.0925 .0470 0 0 8 7.3203 7.2986 .0579 2 5 6 2.9936 2.9930 .0359 0 1 8 3.7231 3.6709 .0363 0 4 7 2.5019 2.4952 .0369 4 5 5 5.3626 5.3693 .0484 1 1 8 6.4869 6.4518 .0534 1 4 7 5.2960 5.2723 .0431 4 4 6 6.2397 6.2447 .0518 0 2 8 6.7188 6.7170 .0510 2 4 7 2.4763 2.5047 .0369 1 2 8 3.5376 3.4945 .0359 3 5 6 5.3041 5.3189 .0429 0 6 6 5.9138 5.9023 .0508 2 2 8 6.1242 6.1990 .0512 0 3 8 3.2519 3.2777 .0359 1 6 6 3.0180 3.1257 .0466 1 3 8 5.4741 5.5361 .0440 0 5 7 4.4778 4.5562 .0389 3 4 7 4.7062 4.6915 .0401 2 6 6 5.4870 5.4803 .0488 4 5 6 2.7591 2.7929 .0355 2 3 8 3.1043 3.1410 .0357 2 5 7 4.2715 4.3418 .0381 0 4 8 5.2708 5.3375 .0427 1 4 8 3.0813 3.0654 .0351 3 6 6 2.8097 2.8637 .0460 3 3 8 4.7504 4.7999 .0458 0 1 9 3.8417 3.8193 .0365 2 4 8 4.9583 4.9578 .0421 0 6 7 2.4843 2.4622 .0353 5 5 6 4.1624 4.1365 .0442 1 2 9 3.7283 3.6759 .0369 1 6 7 4.0951 4.1042 .0367 4 6 6 4.4004 4.4477 .0494 3 4 8 2.7835 2.7873 .0337 0 5 8 2.7251 2.7130 .0335 4 5 7 3.7834 3.7520 .0345 1 5 8 4.2169 4.1954 .0385 0 3 9 3.5289 3.5017 .0361 2 5 8 2.6509 2.6152 .0393 3 6 7 3.7150 3.6599 .0351 2 3 9 3.3606 3.3625 .0361 4 4 8 4.0808 4.0271 .0464 5 6 6 2.4125 2.4406 .0395 3 5 8 3.8142 3.6930 .0375 1 4 9 3.2469 3.2505 .0365 0 7 7 3.3674 3.3048 .0452 0 6 8 3.8170 3.8103 .0409 0 0 10 4.2979 4.2838 .0413 1 6 8 2.5537 2.5193 .0365 0 1 10 2.8684 2.8720 .0310 4 6 7 2.2434 2.2511 .0361 1 1 10 4.0058 4.0114 .0405 2 7 7 3.1462 3.1534 .0444 0 2 10 3.9975 3.9763 .0349 2 6 8 3.4965 3.5647 .0381 4 5 8 2.3591 2.3430 .0325 1 2 10 2.7051 2.7190 .0339 0 5 9 2.9291 2.9225 .0337 3 4 9 3.0104 2.9589 .0433 2 2 10 3.7027 3.6979 .0411 3 6 8 2.2460 2.3045 .0351 5 6 7 2.9962 2.9379 .0292 2 5 9 2.7926 2.7984 .0304 1 3 10 3.5324 3.4823 .0393 0 7 8 2.1027 2.1202 .0440 4 4 9 1.9234 1.9107 .0462 4 7 7 2.7206 2.7348 .0347 5 5 8 2.8583 2.9080 .0355 3 5 9 1.7708 1.7965 .0351 0 4 10 3.1089 3.2229 .0476 4 6 8 2.9293 2.9485 .0298 2 7 8 2.0942 2.0473 .0419 1 4 10 2.3347 2.3304 .0417 3 3 10 2.9517 3.0451 .0508 1 6 9 2.5783 2.6077 .0343 3 7 8 2.5829 2.5983 .0315 0 1 11 2.1746 2.2101 .0393 4 5 9 2.4220 2.4476 .0315 5 7 7 1.7353 1.7890 .0403 3 4 10 2.1381 2.1042 .0399 0 5 10 2.0789 2.0893 .0446 5 6 8 1.9869 1.9442 .0282 3 6 9 2.4390 2.3635 .0345 1 5 10 2.6761 2.6839 .0327 0 8 8 2.4751 2.5321 .0365 2 5 10 1.9635 1.9936 .0349 4 7 8 1.8617 1.8374 .0266 # Strucrue factors of KMnF3 at 298K data_298K loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_meas _refln_F_calc _refln_F_sigma 0 0 1 14.1009 14.1007 .0723 0 1 1 26.7593 26.8547 .1343 1 1 1 12.9869 12.9509 .0678 0 0 2 45.9529 45.9226 .2307 0 1 2 10.9889 10.9460 .0557 1 1 2 21.8297 21.6663 .1098 0 2 2 33.2349 33.4228 .1671 0 0 3 7.5814 7.5723 .0408 1 2 2 9.0478 8.9414 .0461 0 1 3 17.0371 17.0476 .0866 1 1 3 3.0462 3.0932 .0325 2 2 2 26.2663 26.2125 .1339 0 2 3 6.3909 6.4455 .0345 1 2 3 14.9075 15.0264 .0752 0 0 4 22.1967 21.8940 .1170 0 1 4 6.6677 6.7164 .0359 2 2 3 5.6746 5.6590 .0347 1 1 4 14.3296 14.3922 .0727 0 3 3 12.5177 12.6881 .0668 0 2 4 18.3975 18.4259 .0940 1 2 4 5.7755 5.8507 .0331 2 3 3 11.5275 11.5867 .0664 2 2 4 15.8731 15.8578 .0807 0 0 5 3.4906 3.4764 .0335 0 3 4 4.7612 4.7324 .0296 0 1 5 9.9657 9.9209 .0535 1 3 4 11.0993 11.1587 .0592 2 3 4 4.3746 4.3683 .0292 0 2 5 3.3583 3.3767 .0282 1 2 5 9.1808 9.2223 .0496 0 4 4 12.3950 12.3876 .0705 1 4 4 4.4603 4.4823 .0357 2 2 5 3.3146 3.2952 .0359 3 3 4 9.0548 9.0566 .0521 0 3 5 8.1982 8.2608 .0441 2 4 4 11.1290 11.0451 .0627 0 0 6 11.6060 11.4992 .0662 0 1 6 4.5544 4.5062 .0304 1 1 6 9.2119 9.1563 .0531 2 3 5 7.7241 7.7295 .0425 0 2 6 10.2853 10.2912 .0551 1 2 6 4.1819 4.2129 .0300 3 4 4 3.7671 3.7384 .0369 0 4 5 3.1652 3.2047 .0292 1 4 5 7.4515 7.4705 .0410 2 2 6 9.2787 9.2679 .0529 2 4 5 3.1483 3.1381 .0296 0 3 6 3.7849 3.7839 .0296 1 3 6 7.5206 7.5616 .0414 4 4 4 8.2228 8.1919 .0594 0 0 7 2.3031 2.2930 .0478 2 3 6 3.6461 3.6095 .0302 3 4 5 6.3632 6.3550 .0367 0 1 7 5.7837 5.7110 .0347 0 5 5 6.0079 5.9754 .0404 0 4 6 7.6412 7.6811 .0425 1 4 6 3.6280 3.6190 .0304 0 2 7 2.4143 2.3654 .0341 1 2 7 5.4399 5.4250 .0337 2 5 5 5.6833 5.6376 .0398 3 3 6 6.3367 6.3644 .0416 2 4 6 6.9701 7.0049 .0396 2 2 7 2.4062 2.4086 .0486 4 4 5 2.9497 2.9604 .0439 0 3 7 5.0253 5.0294 .0331 3 4 6 3.2224 3.2059 .0322 0 5 6 2.9156 2.9842 .0333 2 3 7 4.7966 4.7760 .0331 1 5 6 5.3989 5.4068 .0347 0 0 8 6.4494 6.4065 .0427 0 4 7 2.3815 2.4420 .0361 2 5 6 2.9379 2.8928 .0327 0 1 8 3.5433 3.5599 .0316 1 1 8 5.7425 5.6740 .0420 4 5 5 4.7925 4.7307 .0404 1 4 7 4.6196 4.6169 .0329 0 2 8 5.8946 5.8601 .0361 4 4 6 5.4444 5.4390 .0412 2 4 7 2.4499 2.4250 .0355 1 2 8 3.3647 3.3660 .0322 3 5 6 4.6780 4.6668 .0331 2 2 8 5.3975 5.3750 .0414 0 6 6 5.1116 5.1213 .0404 0 3 8 3.1616 3.1295 .0320 1 6 6 2.9805 2.9843 .0435 0 5 7 3.9099 3.9240 .0316 3 4 7 4.0744 4.0681 .0318 1 3 8 4.8007 4.8185 .0331 2 6 6 4.7335 4.7235 .0406 2 3 8 2.9807 2.9748 .0325 4 5 6 2.5978 2.6285 .0343 2 5 7 3.7129 3.7287 .0308 0 4 8 4.5088 4.5776 .0320 4 4 7 2.2990 2.3139 .0498 1 4 8 2.8752 2.8871 .0327 3 6 6 2.6789 2.6803 .0457 0 1 9 3.2657 3.2315 .0308 3 3 8 4.1411 4.1340 .0386 2 4 8 4.2079 4.2261 .0310 0 6 7 2.3207 2.2946 .0349 5 5 6 3.5888 3.5474 .0392 1 2 9 3.0852 3.1020 .0312 1 6 7 3.4879 3.5077 .0306 4 6 6 3.7992 3.7647 .0386 3 4 8 2.5911 2.5756 .0324 2 6 7 2.2233 2.2286 .0357 0 5 8 2.5101 2.5078 .0329 4 5 7 3.2107 3.1855 .0304 0 3 9 2.9426 2.9384 .0310 1 5 8 3.5914 3.5746 .0302 2 5 8 2.3741 2.3954 .0333 3 6 7 3.1081 3.0974 .0298 2 3 9 2.7956 2.8136 .0312 4 4 8 3.3963 3.3755 .0382 0 7 7 2.7799 2.7551 .0410 3 5 8 3.1409 3.1142 .0292 1 4 9 2.6807 2.7132 .0308 0 6 8 3.1879 3.1853 .0290 0 0 10 3.5516 3.5507 .0365 0 1 10 2.6262 2.5927 .0298 1 6 8 2.2766 2.2814 .0322 2 7 7 2.6148 2.6213 .0408 1 1 10 3.3693 3.3315 .0363 0 2 10 3.2648 3.2829 .0282 2 6 8 2.9264 2.9622 .0284 4 5 8 2.0939 2.0902 .0322 1 2 10 2.4407 2.4390 .0298 0 5 9 2.3947 2.4068 .0300 3 4 9 2.4221 2.4482 .0298 2 2 10 3.0105 3.0404 .0359 6 6 6 2.6348 2.6816 .0627 3 6 8 2.0604 2.0457 .0306 0 3 10 2.2429 2.2835 .0292 5 6 7 2.4376 2.4359 .0288 1 3 10 2.8407 2.8704 .0273 2 5 9 2.2998 2.2976 .0294 2 3 10 2.1447 2.1534 .0292 1 7 8 2.3933 2.3977 .0284 5 5 8 2.3678 2.4014 .0380 4 7 7 2.2664 2.2480 .0384 4 6 8 2.4064 2.4096 .0273 0 4 10 2.6139 2.6295 .0265 3 3 10 2.5031 2.4890 .0320 4 5 9 1.9137 1.9865 .0273 0 8 8 2.1031 2.0458 .0288 1 8 8 1.6549 1.6535 .0337