h2-h2o-class1.car
5f9001a59de0efficient_neuronet

h2-h2o-class1.car
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			!BIOSYM archive 3
			PBC=ON
			Materials Studio Generated CAR File
			!DATE Tue Jul 02 12:42:22 2013
			PBC 10.0000 10.0000 10.0000 90.0000 90.0000 90.0000 (P1)
			H1 4.600000000 5.000000000 2.500000000 HYDR 1 h H 0.000
			H2 5.400000000 5.000000000 2.500000000 HYDR 1 h H 0.000
			end
			O1 5.000000000 5.000000000 7.500000000 TIP3 2 otip O -0.834
			H2 4.000000000 5.000000000 7.500000000 TIP3 2 htip H 0.417
			H3 5.000000000 4.000000000 7.500000000 TIP3 2 htip H 0.417
			end
			end