FILEID collect Tue Sep 28 1 4.00 12/03/04 09:00:17 04src1119 SITEID Southampton TITLE /home/diska/04src1119 CHEM C72 H64 N36 O32 Cl8 Mn4 CELL 20.4549 25.3319 25.1337 89.9528 111.5397 90.0527 12113.741 CELLSD 0.0089 0.0089 0.0061 0.0163 0.0143 0.0254 2.797 ORT1 -2.7823000e-02 -2.9829500e-02 7.0854000e-03 ORT2 4.4424100e-02 -1.6961900e-02 2.5900200e-02 ORT3 -3.8458000e-03 1.9515400e-02 3.3296200e-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 Orange CSIZE 0.18 x 0.15 x 0.08 ADPAR 312.5000 288.0000 5.000000000512 ADCOR -1.3703 -0.1903 0.0000 -0.5877 0.1154 -0.2220 BRAVAIS Monoclinic(b-unique) P