Diffusion MOLEKUEHL (master) Browse

R11301/amons-qm9/frag_10_c00001.sdf
83ee1e954e70master

frag_10_c00001.sdf
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			RDKit 3D

			7 6 0 0 0 0 0 0 0 0999 V2000
			1.4245 1.7636 -0.0335 C 0 0 0 0 0 0 0 0 0 0 0 0
			2.5750 1.2750 -0.3387 N 0 0 0 0 0 0 0 0 0 0 0 0
			3.6484 2.1249 -0.2516 C 0 0 0 0 0 0 0 0 0 0 0 0
			4.8006 1.7959 -0.5107 O 0 0 0 0 0 0 0 0 0 0 0 0
			0.5311 1.1205 -0.0878 H 0 0 0 0 0 0 0 0 0 0 0 0
			1.2582 2.8067 0.2876 H 0 0 0 0 0 0 0 0 0 0 0 0
			3.4524 3.1633 0.0717 H 0 0 0 0 0 0 0 0 0 0 0 0
			1 2 2 3
			2 3 1 0
			3 4 2 0
			1 5 1 0
			1 6 1 0
			3 7 1 0
			M END