TITL 04src0562 in P2(1)/c CELL 0.71073 8.2970 7.8983 24.1223 90.000 92.362 90.000 ZERR 2.00 0.0012 0.0030 0.0039 0.000 0.021 0.000 LATT 1 SYMM - X, 1/2 + Y, 1/2 - Z SFAC C H B UNIT 76 100 4 MERG 2 OMIT -3.00 55.00 OMIT 7 2 22 EXTI 0.01408 FMAP 2 PLAN 10 SIZE 0.01 0.06 0.08 ACTA BOND $H WGHT 0.02610 2.25790 L.S. 4 TEMP -153.00 FVAR 0.57662 C1 1 0.308044 0.175456 0.560491 11.00000 0.02130 0.02141 = 0.03228 -0.00391 -0.00097 -0.00281 C2 1 0.139449 0.184094 0.549348 11.00000 0.02442 0.02661 = 0.02798 -0.00310 -0.00106 0.00018 C3 1 0.019077 0.119027 0.589215 11.00000 0.02002 0.03852 = 0.03421 0.00035 0.00036 -0.00110 AFIX 137 H3A 2 -0.070229 0.199687 0.591269 11.00000 -1.50000 H3B 2 0.071744 0.105776 0.626073 11.00000 -1.50000 H3C 2 -0.022655 0.009252 0.576258 11.00000 -1.50000 AFIX 0 C4 1 0.079121 0.258222 0.500459 11.00000 0.02188 0.03318 = 0.02976 -0.00488 -0.00548 0.00094 AFIX 43 H4 2 -0.034395 0.264374 0.493844 11.00000 -1.20000 AFIX 0 C5 1 0.179204 0.323421 0.461067 11.00000 0.02959 0.02910 = 0.02563 -0.00045 0.00000 0.00467 C6 1 0.110039 0.402481 0.408534 11.00000 0.03548 0.04196 = 0.03276 0.00190 -0.00400 0.00454 AFIX 137 H6A 2 0.061082 0.314346 0.384718 11.00000 -1.50000 H6B 2 0.196262 0.458817 0.388967 11.00000 -1.50000 H6C 2 0.027737 0.485759 0.417711 11.00000 -1.50000 AFIX 0 C7 1 0.345400 0.313818 0.472383 11.00000 0.02840 0.03233 = 0.02769 -0.00180 0.00232 -0.00085 AFIX 43 H7 2 0.416289 0.358184 0.446066 11.00000 -1.20000 AFIX 0 C8 1 0.410251 0.242009 0.520536 11.00000 0.02146 0.02544 = 0.02758 -0.00367 -0.00059 -0.00283 C9 1 0.591955 0.230550 0.528472 11.00000 0.02549 0.03229 = 0.03504 0.00216 0.00013 -0.00176 AFIX 137 H9A 2 0.624624 0.111315 0.529441 11.00000 -1.50000 H9B 2 0.626084 0.285258 0.563482 11.00000 -1.50000 H9C 2 0.642728 0.287664 0.497627 11.00000 -1.50000 AFIX 0 C10 1 0.491544 0.202852 0.656609 11.00000 0.02266 0.02639 = 0.02147 0.00262 0.00051 0.00038 C11 1 0.643870 0.141459 0.676720 11.00000 0.02474 0.03082 = 0.02341 0.00220 0.00216 0.00111 C12 1 0.701532 -0.037075 0.666740 11.00000 0.02592 0.03332 = 0.04082 -0.00103 -0.00691 0.00335 AFIX 137 H12A 2 0.815898 -0.046265 0.678194 11.00000 -1.50000 H12B 2 0.687465 -0.064218 0.627194 11.00000 -1.50000 H12C 2 0.638618 -0.116494 0.688360 11.00000 -1.50000 AFIX 0 C13 1 0.749425 0.248510 0.706297 11.00000 0.02250 0.03833 = 0.02553 0.00366 -0.00794 0.00258 AFIX 43 H13 2 0.852087 0.206290 0.718482 11.00000 -1.20000 AFIX 0 C14 1 0.709811 0.415267 0.718645 11.00000 0.02482 0.03728 = 0.02102 0.00245 -0.00211 -0.00466 C15 1 0.830009 0.529833 0.747596 11.00000 0.03442 0.04977 = 0.03080 -0.00483 -0.00102 -0.00497 AFIX 137 H15A 2 0.896642 0.464142 0.774298 11.00000 -1.50000 H15B 2 0.773017 0.618901 0.767194 11.00000 -1.50000 H15C 2 0.899008 0.581412 0.720237 11.00000 -1.50000 AFIX 0 C16 1 0.556155 0.470169 0.702839 11.00000 0.03292 0.02852 = 0.02514 -0.00091 -0.00005 -0.00207 AFIX 43 H16 2 0.522599 0.579853 0.713687 11.00000 -1.20000 AFIX 0 C17 1 0.449526 0.368903 0.671472 11.00000 0.02029 0.02907 = 0.02634 0.00450 -0.00152 -0.00147 C18 1 0.286200 0.444838 0.655476 11.00000 0.03051 0.02912 = 0.04028 -0.00649 -0.00496 0.00476 AFIX 137 H18A 2 0.285008 0.481397 0.616638 11.00000 -1.50000 H18B 2 0.266158 0.542479 0.679295 11.00000 -1.50000 H18C 2 0.201937 0.359686 0.660162 11.00000 -1.50000 AFIX 0 C19 1 0.346510 -0.098601 0.625585 11.00000 0.02682 0.02996 = 0.03737 0.00049 -0.00050 0.00121 AFIX 137 H19A 2 0.426185 -0.166672 0.606615 11.00000 -1.50000 H19B 2 0.237975 -0.126887 0.610876 11.00000 -1.50000 H19C 2 0.354276 -0.122711 0.665458 11.00000 -1.50000 AFIX 0 B1 3 0.380239 0.094038 0.615682 11.00000 0.01752 0.03019 = 0.03216 -0.00182 0.00658 0.00467 HKLF 4 END