 water-b3lyp-ultrafine Gradient=SCF
 Electron density from Total SCF Density
    3    0.000000    0.000000    0.000000    4
    4    0.000000    0.000000    0.000000
    1    0.000000    0.000000    0.000000
    1    0.000000    0.000000    0.000000
    8    8.000000    0.000000    0.000000    0.000000
    1    1.000000    0.000000    1.430523    1.109269
    1    1.000000    0.000000   -1.430523    1.109269
 0.450000000000 0.300000000000 0.350000000000 0.255917615253 -0.439653648545 -0.231511901396 -0.302823203561
 -0.650000000000 0.250000000000 0.400000000000 0.117302641512 0.252968632668 -0.079410549660 -0.146482227518
 0.250000000000 -0.350000000000 1.200000000000 0.019729951100 -0.013361046508 -0.006402127563 -0.045096862548
 0.200000000000 1.100000000000 0.600000000000 0.067752436595 -0.078241338618 -0.160354183613 -0.022438891287
