From owner-chemistry@ccl.net Tue Jun  9 16:01:00 2020
From: "Ibtesam Mohammed Desoky girl51115++yahoo.com" <owner-chemistry]![server.ccl.net>
To: CCL
Subject: CCL: conformation analysis
Message-Id: <-54089-200609155642-7110-hGNCi7702wDtR6cqIKL2vA]![server.ccl.net>
X-Original-From: "Ibtesam Mohammed Desoky" <girl51115 _ yahoo.com>
Date: Tue, 9 Jun 2020 15:56:41 -0400


Sent to CCL by: "Ibtesam Mohammed Desoky" [girl51115!^!yahoo.com]



Dear all,


I have used PCModel v 9.30 to perform  conformation analysis for an 
ammonium salt that containing iodide but this error appeared can anyone 
tell me what the solution, please 

 parameters missing. See  pcmod.err for information

and the error file is

Specific Angle parameters missing for angle 71-29-73, types: 8-1-6
Specific Angle parameters missing for angle 71-30-72, types: 8-1-6
Specific Angle parameters missing for angle 75-31-76, types: 6-1-8
Specific Angle parameters missing for angle 74-32-76, types: 6-1-8
Torsion constants missing: angle: 29 71 30 72  types: 1 8 1 6
Torsion constants missing: angle: 30 71 29 73  types: 1 8 1 6
Torsion constants missing: angle: 31 76 32 74  types: 1 8 1 6
Torsion constants missing: angle: 32 76 31 75  types: 1 8 1 6
Torsion constants missing: angle: 33 76 31 75  types: 1 8 1 6
Torsion constants missing: angle: 33 76 32 74  types: 1 8 1 6
Torsion constants missing: angle: 39 71 29 73  types: 1 8 1 6
Torsion constants missing: angle: 39 71 30 72  types: 1 8 1 6



Best regards,
Ibtesam