Titanium (QZ, all electron, 13S 8P 5D 3F) BASIS 1S 105.000 1S 27.950 1S 20.400 2S 18.100 2S 9.450 2S 7.250 3S 5.450 3S 3.800 3S 2.700 4S 2.200 4S 1.500 4S 1.050 4S .750 2P 17.550 2P 10.100 2P 7.000 3P 5.400 3P 3.550 3P 2.300 4P 2.000 4P 1.000 3D 8.650 3D 4.500 3D 2.500 3D 1.400 3D .810 4F 4.000 4F 2.000 4F 1.000 END CORE 0 0 0 0 END DESCRIPTION 0/ END FIT 1S 210.00 1S 161.16 1S 123.68 1S 94.91 1S 72.84 1S 55.90 1S 34.91 2S 40.31 2S 28.01 3S 28.53 3S 20.98 3S 15.43 4S 14.98 4S 11.43 4S 8.71 5S 8.27 5S 6.47 5S 5.07 6S 4.75 6S 3.79 6S 3.02 7S 2.81 7S 2.28 7S 1.85 7S 1.50 2P 38.05 2P 24.16 3P 22.61 3P 15.41 4P 13.92 4P 9.93 5P 8.84 5P 6.51 6P 5.76 6P 4.35 7P 3.83 7P 2.95 7P 2.27 7P 1.75 3D 30.45 3D 19.68 4D 16.91 4D 11.51 5D 9.80 5D 6.92 6D 5.88 6D 4.27 7D 3.63 7D 2.69 7D 2.00 4F 29.95 4F 18.40 5F 14.22 5F 9.16 6F 7.12 6F 4.75 7F 3.72 7F 2.55 7F 1.75 5G 12.10 5G 7.65 6G 5.85 6G 3.84 7G 2.96 7G 2.00 END FITCOEFFICIENTS / END