FILEID collect Tue Sep 28 1 4.00 02/14/05 16:36:11 05thg021 SITEID Southampton TITLE /home/diska/05thg021 CHEM CELL 5.5528 16.0180 11.7768 89.9429 103.3775 90.0131 1019.071 CELLSD 0.0006 0.0018 0.0019 0.0107 0.0089 0.0095 0.210 ORT1 -5.9714000e-02 4.4826000e-02 4.5795000e-02 ORT2 2.4836700e-02 4.2433100e-02 -5.8580400e-02 ORT3 -1.7344530e-01 -9.3564000e-03 -4.5706900e-02 SOURCE MO 0.71073 0.70930 0.71359 2.00000 0.00 0.00 LIMITS -45.00 60.00 -210.00 210.00 -360.00 360.00 -100.00 100.00 -360.00 360.00 MORPH Block DNSMET ? CCOLOR Colourless CSIZE 0.2 x 0.2 x 0.2 ADPAR 312.5000 288.0000 3.000000000512 ADCOR -1.3711 -0.1843 0.0000 -0.5824 0.1302 -0.2390 BRAVAIS Monoclinic(b-unique) P