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PM7 Titanium(IV) oxide dichloride I=7.89 IR=PW91D D=2.98 DR=PW91D H=-130.39 HR=NIST Ti 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0 Cl 2.15700465 +1 0.0000000 +0 0.0000000 +0 1 0 0 Cl 2.15750855 +1 125.0267568 +1 0.0000000 +0 1 2 0 O 1.64348676 +1 117.7248447 +1 179.4014323 +1 1 2 3