|
SYMMETRY PM7 TiCl(NH2)3 <Ti-Cl> <Ti-N> <Cl-Ti-N> GR=SFK00 Ti 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 Cl 2.25900000 +1 0.0000000 +0 0.0000000 +0 1 0 0 N 1.88900000 +1 111.8500000 +1 0.0000000 +0 1 2 0 N 1.88900000 +0 111.8500000 +0 120.0000000 +0 1 2 3 N 1.88900000 +0 111.8500000 +0 -120.0000000 +0 1 2 3 H 1.01136102 +1 122.3181710 +1 -53.2032306 +1 3 1 2 H 1.00450903 +1 131.3693355 +1 126.8570124 +1 3 1 2 H 1.01126624 +1 122.1864868 +1 -54.8399599 +1 4 1 2 H 1.00435345 +1 131.5008533 +1 125.4806691 +1 4 1 2 H 1.01122698 +1 123.0875499 +1 -54.9699893 +1 5 1 2 H 1.00576930 +1 130.7939014 +1 125.0268405 +1 5 1 2 3 1 4 3 2 4