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bingfei101

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[交流] 【求助】Gauss计算出错求助，no atoms in gcona？

Gauss计算还没开始算就停止，出现There are no atoms in GConA.
请问是什么原因？计算结果如下：
*********************************************
Gaussian 03:  x86-Win32-G03RevB.01 3-Mar-2003
               14-Jul-2009
*********************************************
Default route:  MaxDisk=2000MB
-------------------------
# OPT FREQ B3LYP/6-31G(d)
-------------------------
1/14=-1,18=20,26=3,38=1/1,3;
2/9=110,17=6,18=5,40=1/2;
3/5=1,6=6,7=1,11=2,16=1,25=1,30=1,74=-5/1,2,3;
4//1;
5/5=2,38=5/2;
6/7=2,8=2,9=2,10=2,28=1/1;
7//1,2,3,16;
1/14=-1,18=20/3(1);
99//99;
2/9=110/2;
3/5=1,6=6,7=1,11=2,16=1,25=1,30=1,74=-5/1,2,3;
4/5=5,16=3/1;
5/5=2,38=5/2;
7//1,2,3,16;
1/14=-1,18=20/3(-5);
2/9=110/2;
6/7=2,8=2,9=2,10=2,19=2,28=1/1;
99/9=1/99;
----------------------------------------------------------------------
b3lyp/6-311++G** OPT freq 4 1 0P 1e -7.18382182 -693.14325627 TIPnP=5
20 11
----------------------------------------------------------------------
Symbolic Z-matrix:
Charge = -1 Multiplicity = 2

There are no atoms in GConA.
Error termination via Lnk1e in C:\G03W\l101.exe at Tue Jul 14 16:03:05 2009.
Job cpu time:  0 days  0 hours  0 minutes  1.0 seconds.
File lengths (MBytes):  RWF=    7 Int=    0 D2E=    0 Chk=    1 Scr=    1

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