TITL 01src008 in P-1 CELL 0.71073 6.6845 8.8858 11.3118 103.531 103.033 93.107 ZERR 2.00 0.0003 0.0005 0.0006 0.002 0.003 0.003 LATT 1 SFAC C H N O UNIT 30 26 6 4 MERG 2 OMIT -3.00 55.00 OMIT -4 6 5 OMIT -2 1 1 EXTI 0.05447 FMAP 2 list 3 PLAN 10 SIZE 0.12 0.16 0.18 ACTA BOND $H WGHT 0.05180 0.04360 L.S. 4 TEMP -153.00 FVAR 1.00245 C1 1 0.249438 0.496311 0.492256 11.00000 0.01379 0.01642 = 0.02278 0.00811 0.00641 0.00416 C2 1 0.180063 0.364420 0.394280 11.00000 0.01880 0.02070 = 0.02123 0.00571 0.00463 0.00402 AFIX 43 H2 2 0.150864 0.369656 0.309257 11.00000 -1.20000 AFIX 0 C3 1 0.155247 0.224157 0.426328 11.00000 0.01925 0.01693 = 0.02902 0.00506 0.00637 0.00199 AFIX 43 H3 2 0.107731 0.131227 0.361611 11.00000 -1.20000 AFIX 0 C4 1 0.198084 0.216267 0.550472 11.00000 0.01883 0.01995 = 0.03340 0.01194 0.00930 0.00388 AFIX 43 H4 2 0.179034 0.118485 0.569216 11.00000 -1.20000 AFIX 0 C5 1 0.268435 0.349475 0.647639 11.00000 0.01746 0.02468 = 0.02370 0.01065 0.00656 0.00301 AFIX 43 H5 2 0.298171 0.343921 0.732591 11.00000 -1.20000 AFIX 0 C6 1 0.294279 0.490916 0.617717 11.00000 0.01432 0.02099 = 0.02110 0.00583 0.00661 0.00344 C7 1 0.360331 0.732504 0.625757 11.00000 0.01541 0.02060 = 0.01827 0.00497 0.00406 0.00259 C8 1 0.502281 0.955599 0.797683 11.00000 0.03882 0.02624 = 0.02110 0.00149 0.00443 -0.00792 AFIX 137 H8A 2 0.407409 0.930821 0.846801 11.00000 -1.50000 H8B 2 0.528571 1.068915 0.812911 11.00000 -1.50000 H8C 2 0.632855 0.912939 0.822740 11.00000 -1.50000 AFIX 0 C9 1 0.271806 0.728556 0.400246 11.00000 0.01558 0.01921 = 0.01997 0.00594 0.00448 0.00374 C10 1 0.161996 0.675081 0.179593 11.00000 0.02264 0.02163 = 0.01596 0.00636 0.00183 -0.00509 C11 1 0.261527 0.606781 0.090142 11.00000 0.02796 0.02330 = 0.02391 0.00078 0.00567 -0.00325 AFIX 43 H11 2 0.353401 0.531605 0.105097 11.00000 -1.20000 AFIX 0 C12 1 0.224853 0.650026 -0.022224 11.00000 0.04241 0.03291 = 0.02104 -0.00042 0.00947 -0.01182 AFIX 43 H12 2 0.293850 0.605609 -0.084598 11.00000 -1.20000 AFIX 0 C13 1 0.088626 0.757237 -0.043716 11.00000 0.04567 0.03576 = 0.01775 0.01013 -0.00278 -0.01706 AFIX 43 H13 2 0.064883 0.787106 -0.120609 11.00000 -1.20000 AFIX 0 C14 1 -0.013708 0.821559 0.046207 11.00000 0.03189 0.02682 = 0.02986 0.01386 -0.00390 -0.00615 AFIX 43 H14 2 -0.110165 0.893315 0.029843 11.00000 -1.20000 AFIX 0 C15 1 0.023583 0.782006 0.159852 11.00000 0.02487 0.02352 = 0.02419 0.00865 0.00478 -0.00250 AFIX 43 H15 2 -0.044184 0.827168 0.222663 11.00000 -1.20000 AFIX 0 N1 3 0.363251 0.638236 0.699032 11.00000 0.01939 0.02023 = 0.02045 0.00548 0.00484 0.00094 N2 3 0.410581 0.887734 0.665430 11.00000 0.02526 0.01761 = 0.02001 0.00496 0.00547 -0.00073 N3 3 0.292017 0.656060 0.497002 11.00000 0.01749 0.01628 = 0.01747 0.00520 0.00363 0.00277 O1 4 0.315619 0.865709 0.413036 11.00000 0.02631 0.01694 = 0.02335 0.00638 0.00446 0.00120 O2 4 0.196551 0.622703 0.289863 11.00000 0.02737 0.01836 = 0.01634 0.00521 0.00290 0.00047 H2A 2 0.435956 0.938974 0.608992 11.00000 0.03155 HKLF 4 END