# Template for packmol in Galaxy
#  

tolerance 2.0
nloop  20 
maxit  20 
seed  101 
filetype pdb 
output /tmp/tmprvsgniri/files/000/dataset_2.dat

structure /tmp/tmprvsgniri/files/000/dataset_1.dat
# Galaxy datasetname - water.pdb
  number 100
  radius 1.0
  resnumbers 0 
  inside cube 0.0 0.0 0.0 40.0
end structure

