Diffusion MOLEKUEHL (master) Browse

R11301/qm7/qm7_1069.xyz
385c016290e9master

qm7_1069.xyz
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			15
			-1405.97
			C 1.61590 -0.29958 -0.71808
			O 3.02002 -0.18493 -0.51865
			N 3.32062 1.16058 -0.26048
			C 4.59218 1.32557 -0.05248
			C 5.61046 0.21307 -0.09369
			C 5.09724 2.71998 0.20930
			H 1.38006 -1.34753 -0.91806
			H 1.30466 0.30273 -1.57702
			H 1.07840 0.01784 0.18071
			H 5.27427 -0.63348 0.51106
			H 6.56828 0.56150 0.30287
			H 5.75208 -0.10768 -1.12933
			H 4.27089 3.43631 0.22248
			H 5.80254 3.00172 -0.57768
			H 5.60732 2.74557 1.17623