FILEID collect      Tue Sep 28 1  4.00        05/08/05 20:10:40 2005slh0428  
SITEID Southampton
TITLE  /home/diska/2005slh0428                  
CHEM   C46 H54 N4 O4 P2 S4 Ni1 Pt1 
CELL     10.2973   29.8250    9.3067   90.0823   90.4174   89.9976   2858.153 
CELLSD    0.0008    0.0050    0.0011    0.0130    0.0100    0.0110     0.666 
ORT1      1.8960350e-02  -2.7200850e-02  -5.9191400e-02 
ORT2     -2.1685050e-02   1.7114050e-02  -8.9325700e-02 
ORT3      9.2745000e-02   9.5612000e-03  -7.9651000e-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  Slab
DNSMET ? 
CCOLOR   Green
CSIZE  0.2 x 0.1 x 0.04
ADPAR      312.5000    288.0000      3.500000000512 
ADCOR       -1.2994     -0.2179      0.0000     -0.6045      0.1409     -0.2154 
BRAVAIS Monoclinic(b-unique)  C