Ti 1.0000000000000000 -1.6330681005367900 1.6330681005367900 1.6330681005367900 1.6330681005367900 -1.6330681005367900 1.6330681005367900 1.6330681005367900 1.6330681005367900 -1.6330681005367900 Ti 1 Cartesian 0.0000000000000000 0.0000000000000000 0.0000000000000000