28 Coordinates from ORCA-job AcrH2ylium H -0.07057072244719 -0.76716149922287 0.36764621113829 C 0.01090822380019 0.11340747551095 -0.27501600215832 H -0.03820602981230 -0.28913306744620 -1.29927832922756 C 1.32378166951116 0.76790671556771 -0.09481438771784 C -1.14727115848758 1.00949185957386 -0.07532645778473 C 1.42334417777524 2.17280391799837 -0.11448261268543 C 2.67952476569248 2.78391155543073 0.03155778761390 C 3.80470613151311 2.01275891035255 0.17638534321805 C 3.71172761277591 0.62299370853998 0.17686691122618 C 2.47767202616768 0.01714689057950 0.04688780911968 C -2.41997990000315 0.49453117705121 0.09607030952522 C -3.51537059422698 1.32574820853377 0.22068021041041 C -3.34584170126700 2.70759448961675 0.18251966408807 C -2.09565669851331 3.24876406292382 0.01792342587867 C -0.97794571866288 2.40784449016202 -0.11435448176577 H 2.77175045753608 3.85940163047412 0.06161547473465 H 4.76640521574542 2.49491988381708 0.29908117612039 H 4.60311569531819 0.01830191592340 0.28900358147474 H 2.39862136556171 -1.06401293291002 0.05464022357409 H -4.19948525123159 3.36430891302466 0.29329100141908 H -1.98368007371750 4.32260409542330 0.02326623557520 H -2.54715547813646 -0.58163859715644 0.12784791855319 H -4.50330907460448 0.90238128226624 0.35409721302857 N 0.28600422300425 2.93914585172327 -0.26505830468768 C 0.42659752087782 4.35814392934563 -0.52982004790336 H -0.42180173486111 4.70227937924795 -1.11012704244839 H 1.32518932985455 4.52833112764848 -1.11187977534509 H 0.48386572083774 4.92110462600018 0.40373694502580