There are 37 ligand heavy atoms
Ligand center of coords (x y z): 14.8518648648649 13.319 34.5868108108108
useligsph flag does not exist.
Starting number of spheres from all_spheres.sph cluster 0: 1493
FINISHED READING IN FILE all_spheres.sph CLUSTER 0
Number of sphere points after cutting off spheres too far from center of ligand (12 angstroms): 1039
Number of spheres after removing too far (>7 angstroms) and too close to receptor (<1.2 angstroms): 1035
Number of spheres polar: 109, nonpolar: 612, out of current total: 1035
Extents of grid to search are X1 X2 Y1 Y2 Z1 Z2: 2.89742 26.84377 1.34102 23.28983 22.71918 46.55169
Number of spheres after removing spheres too close to each other (approximately <1.5 angstroms): 381
Number of spheres after second pass removing spheres absolutely <0.8 from each other: 288
No crystallographic spheres present, so determining sphere nearest center of ligand (x y z): 14.8518648648649 13.319 34.5868108108108
Center point: 114 xyz: 15.77846 13.02810 35.85901
After continuity checking, number of spheres is: 254
Spheres center of coords (x y z): 12.3914896062992 11.0819563779528 36.2705880314961
Not crystallographic ligand, so keeping spheres closest to center of receptor, center of ligand, and center of spheres
Receptor center of coords (x y z): 30.8688706929194 27.6612313517607 28.9135776221128
Average weighted-distance for final elimination is: 42.9643468570289
Final number of output spheres is: 120
Number of polar spheres: 18
Number of nonpolar spheres: 67
Number of spheres that are near neither polar nor nonpolar receptor atoms: 35
Final number of spheres that are from crystallographic ligand: 0