$system mem=64 disk=-256 $end $control task=optimize theory=qm_n3 basis=qm.in $end $optimize tol=1e-5 step=150 $end $molecule cartesian 6 2.58261339 -0.72419779 2.28278182 6 2.58261339 0.72419779 2.28278182 6 1.41083675 1.17177664 3.00697961 6 0.68663896 0.00000000 3.45455846 6 1.41083675 -1.17177664 3.00697961 6 -0.68663896 0.00000000 3.45455846 6 -1.41083675 -1.17177664 3.00697961 6 -0.72419779 -2.28278182 2.58261339 6 0.72419779 -2.28278182 2.58261339 6 3.00697961 1.41083675 1.17177664 6 2.28278182 2.58261339 0.72419779 6 1.17177664 3.00697961 1.41083675 6 0.72419779 2.28278182 2.58261339 6 -2.58261339 -0.72419779 2.28278182 6 -2.58261339 0.72419779 2.28278182 6 -1.41083675 1.17177664 3.00697961 6 0.00000000 3.45455846 0.68663896 6 -1.17177664 3.00697961 1.41083675 6 -0.72419779 2.28278182 2.58261339 6 -3.00697961 1.41083675 1.17177664 6 -2.28278182 2.58261339 0.72419779 6 -1.17177664 -3.00697961 1.41083675 6 -2.28278182 -2.58261339 0.72419779 6 -3.00697961 -1.41083675 1.17177664 6 -3.45455846 -0.68663896 0.00000000 6 -3.45455846 0.68663896 -0.00000000 6 1.17177664 -3.00697961 1.41083675 6 2.28278182 -2.58261339 0.72419779 6 3.00697961 -1.41083675 1.17177664 6 3.45455846 -0.68663896 0.00000000 6 3.45455846 0.68663896 -0.00000000 6 2.28278182 2.58261339 -0.72419779 6 1.17177664 3.00697961 -1.41083675 6 -0.00000000 3.45455846 -0.68663896 6 -2.28278182 2.58261339 -0.72419779 6 -1.17177664 3.00697961 -1.41083675 6 -3.00697961 1.41083675 -1.17177664 6 0.00000000 -3.45455846 0.68663896 6 3.00697961 1.41083675 -1.17177664 6 2.58261339 0.72419779 -2.28278182 6 2.58261339 -0.72419779 -2.28278182 6 3.00697961 -1.41083675 -1.17177664 6 0.72419779 2.28278182 -2.58261339 6 1.41083675 1.17177664 -3.00697961 6 -3.00697961 -1.41083675 -1.17177664 6 -2.58261339 -0.72419779 -2.28278182 6 -2.58261339 0.72419779 -2.28278182 6 -1.41083675 1.17177664 -3.00697961 6 -0.72419779 2.28278182 -2.58261339 6 -0.00000000 -3.45455846 -0.68663896 6 1.17177664 -3.00697961 -1.41083675 6 2.28278182 -2.58261339 -0.72419779 6 -1.17177664 -3.00697961 -1.41083675 6 -2.28278182 -2.58261339 -0.72419779 6 1.41083675 -1.17177664 -3.00697961 6 0.72419779 -2.28278182 -2.58261339 6 -0.68663896 -0.00000000 -3.45455846 6 0.68663896 0.00000000 -3.45455846 6 -0.72419779 -2.28278182 -2.58261339 6 -1.41083675 -1.17177664 -3.00697961 $end