Problem during sharc-molcas interface while following tutorial

[Kalpa08]

Dear developers

I am running the calculations given in the tutorial. I did the first step (freq and optimization). Then I generated the initial conditions using setup_init.py, prior to that I created the MOLCAS.template file to interface SHARC-MOLCAS. While running the setup_init.py script I faced some odd problems as follow:

In ICOND_00000 directory, the following error came

[kalpa.bhu@login1 ICOND_00000]$ cat QM.log 2023-04-20 11:30:15.213290 cn077 /home/kalpa.bhu/CALC/sharc/tutorial/wigner/init/ICOND_00000

================================================================================ || || || SHARC - MOLCAS - Interface || || || || Authors: Sebastian Mai and Martin Richter || || || || Version: 2.1 || || Date: 01.09.19 || || ||

MOLCAS version 22.1 not supported!

In the rest of the directories I found different error as follow:

[kalpa.bhu@login1 init]$ cd ICOND_00001/ [kalpa.bhu@login1 ICOND_00001]$ cat QM.log 2023-04-20 11:30:15.303933 cn077 /home/kalpa.bhu/CALC/sharc/tutorial/wigner/init/ICOND_00001

================================================================================ || || || SHARC - MOLCAS - Interface || || || || Authors: Sebastian Mai and Martin Richter || || || || Version: 2.1 || || Date: 01.09.19 || || ||

File "MOLCAS.1.JobIph" missing in SAVEDIR! File "MOLCAS.3.JobIph" missing in SAVEDIR! 2 files missing in SAVEDIR=/home/kalpa.bhu/CALC/sharc/tutorial/wigner/init/ICOND_00001/SAVE [kalpa.bhu@login1 ICOND_00001]$

I am attaching both the directories Opt_freq and initial condition directories.

Kindly look into this matter, help us to resolve the issue.