Molecule Viewer
Calculation failed
-------------------------------EPS= 78.39
INPUT FOR CAVITY DEFINITION
---------------------------
ATOM COORDINATES RADIUS EPS
1 -0.9497 0.7120 0.6007 1.9500 78.3900
2 3.0461 -0.6508 -0.4847 1.9500 78.3900
3 1.0482 0.0306 0.0580 0.0000 78.3900
**** ERROR **** PCM SPHERE(S) MUST HAVE A POSITIVE RADIUS
EXECUTION OF GAMESS TERMINATED -ABNORMALLY- AT Tue Sep 15 04:48:00 2020