FILEID collect      Tue Sep 28 1  4.00        01/12/05 09:08:04 05src0006    
SITEID Southampton
TITLE  /home/diska/05src0006                    
CHEM   C21 H22 O2 
CELL      6.2520    9.9679   14.6064   70.8412   85.9193   72.3260    818.846 
CELLSD    0.0017    0.0080    0.0057    0.0742    0.0546    0.0581     0.643 
ORT1      3.8922300e-02  -1.1074090e-01   2.8152400e-02 
ORT2      1.7775100e-02  -8.0201000e-03  -6.6761700e-02 
ORT3      1.6241450e-01  -6.7984000e-03   2.9325000e-03 
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  Rod
DNSMET ? 
CCOLOR  Colourless
CSIZE  0.09 x 0.03 x 0.02
ADPAR      312.5000    288.0000      3.200000000512 
ADCOR       -1.3711     -0.1843      0.0000     -0.5824      0.1302     -0.2390 
BRAVAIS Triclinic             P