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disp3 v o c h 6 20 28 72 92 46 46 8 45 31 31 6 def2-TZVP def2-TZVP def2-TZVP def2-TZVP [6s4p4d1f|17s11p7d1f] [5s3p2d1f|11s6p2d1f] [5s3p2d1f|11s6p2d1f] [3s1p|5s1p] c1 c1(z) ridft 0.17414530 -0.04629328 -0.01476106 0.23050038 -0.07190226 -0.01335051 2023-09-05T12:07:27.682 -8276.892668298 961.9366000000012 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