FILEID collect Tue Sep 28 1 4.00 03/16/07 11:47:53 2007src0400 SITEID Southampton TITLE /diska/2007src0400 CHEM CELL 8.6518 11.3633 16.0178 90.0000 102.0063 90.0000 1540.310 CELLSD 0.0001 0.0001 0.0002 0.0000 0.0008 0.0000 0.030 ORT1 6.0256770e-03 -3.2038927e-02 5.8722106e-02 ORT2 1.9729297e-02 -8.0492043e-02 -2.0715844e-02 ORT3 1.1635097e-01 1.5308047e-02 1.3975148e-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 0.55 x 0.3 x 0.3 ADPAR 312.5000 288.0000 3.000000000512 ADCOR -0.3518 -1.2830 0.0000 -0.6169 0.0466 0.2137 BRAVAIS Monoclinic(b-unique) P