Diffusion MOLEKUEHL (master) Browse

R11301/amons-qm9/frag_16_c00001.sdf
385c016290e9master

frag_16_c00001.sdf
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			none
			RDKit 3D

			9 9 0 0 0 0 0 0 0 0999 V2000
			1.4225 1.7418 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0
			2.5775 1.2858 -0.3369 N 0 0 0 0 0 0 0 0 0 0 0 0
			3.6439 2.1435 -0.2455 C 0 0 0 0 0 0 0 0 0 0 0 0
			4.8169 1.7880 -0.5157 O 0 0 0 0 0 0 0 0 0 0 0 0
			3.4725 3.4445 0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0
			2.1972 3.9586 0.4817 N 0 0 0 0 0 0 0 0 0 0 0 0
			1.2249 3.1413 0.3885 C 0 0 0 0 0 0 0 0 0 0 0 0
			0.1952 3.4298 0.6198 H 0 0 0 0 0 0 0 0 0 0 0 0
			0.5054 1.1419 -0.0784 H 0 0 0 0 0 0 0 0 0 0 0 0
			1 2 2 0
			1 7 1 0
			2 3 1 0
			3 4 2 0
			3 5 1 0
			5 6 1 0
			6 7 2 0
			1 9 1 0
			7 8 1 0
			M END