Hi.
Thanks for your reply.
Of course, I tried to follow these instructions.
The problem is that all parameters are to be listed in .par file.
I don't want to change it. I'd like to specify parameters in .sgm file.
I solved this problem.
So, .sgm file should be^
4.600000
5 4 6 0 0 0 1 1
0.000000
1 C 0 0 0 1 1
CT -0.200000 0.000000
21H 0 0 0 1 1
HC 0.050000 0.000000
32H 0 0 0 1 1
HC 0.050000 0.000000
43H 0 0 0 1 1
HC 0.050000 0.000000
54H 0 0 0 1 1
HC 0.050000 0.000000
1 1 2 0 4
# ^ 4 means to use parameters from the card below
0.209000 2.84512E+05
2 1 3 0 4
# ^ 4 means to use parameters from the card below
0.209000 2.84512E+05
3 1 4 0 4
# ^ 4 means to use parameters from the card below
0.209000 2.84512E+05
4 1 5 0 4
# ^ 4 means to use parameters from the card below
0.209000 2.84512E+05
1 2 1 3 0 0
# ^ 0 means to use parameters from .par file ignoring the card below
0.000000 0.00000E+00
2 2 1 4 0 0
0.000000 0.00000E+00
3 2 1 5 0 0
0.000000 0.00000E+00
4 3 1 4 0 0
0.000000 0.00000E+00
5 3 1 5 0 0
0.000000 0.00000E+00
6 4 1 5 0 0
0.000000 0.00000E+00
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