From owner-chemistry@ccl.net Sat Jan 8 20:25:00 2011 From: "Olawale Lukman Olasunkanmi waleolasunkanmi##gmail.com" To: CCL Subject: CCL: to orca users! Message-Id: <-43568-110108151646-28455-4FHG/9XGMlaK78hTzvnunw.@.server.ccl.net> X-Original-From: "Olawale Lukman Olasunkanmi" Date: Sat, 8 Jan 2011 15:16:45 -0500 Sent to CCL by: "Olawale Lukman Olasunkanmi" [waleolasunkanmi:gmail.com] Hi, Kindly explain to me in simple manner, how I can create orca input file. I have gone through the manuals, I cannot get it right. This is what I have tried: I copied a sample input codes from a manual and pasted it in notepad. I saved it as a .dat file in the orca folder. I went to the command prompt and typed in the orca directory: orca myinputfile But it all resulted in an error. Thank you in anticipation of your response.