File: RP-6306_atrop3.cxsmi

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OC1=C(C)C(N2C3=C(C(C(=O)N)=C2N)C=C(C)C(C)=N3)=C(C)C=C1 |(2.0992,3.5589,;2.2694,2.7517,;1.6554,2.2008,;0.8712,2.4571,;1.8255,1.3935,;1.0637,0.4452,;0.8122,-0.3353,;-0.0126,-0.3353,;-0.264,0.4452,;-1.0482,0.7015,;-1.6621,0.1505,;-1.2182,1.5087,;0.3998,0.9266,;0.3998,1.7516,;-0.425,-1.0498,;-0.0126,-1.7642,;-0.425,-2.4786,;0.8122,-1.7642,;1.2247,-2.4786,;1.2247,-1.0498,;2.6096,1.1372,;2.7797,0.33,;3.2236,1.6882,;3.0535,2.4954,),wU:5.12|