0 1
C 0.00865900 0.01715500 0.68036700
C -1.36834400 0.53555100 0.22505600
C -1.54818700 1.23580200 -0.97506800
C -2.49132200 0.24439900 1.01034000
C -2.82305600 1.63801000 -1.38018300
H -0.68756900 1.47695800 -1.59146100
C -3.76406800 0.64985300 0.60912500
H -2.35210200 -0.30132900 1.93745400
C -3.93535400 1.34836700 -0.58868800
H -2.94305700 2.18307600 -2.31287600
H -4.62404500 0.41808400 1.23228500
H -4.92689400 1.66492800 -0.90131700
C 0.19524900 -1.43426200 0.21468000
C -0.12886700 -1.81562100 -1.09423400
C 0.74423100 -2.38965500 1.07811900
C 0.09032300 -3.12211200 -1.53031900
H -0.56121900 -1.09098700 -1.77654500
C 0.95636900 -3.70010900 0.64338300
H 1.00195700 -2.10092600 2.08966300
C 0.63223700 -4.07220800 -0.66167000
H -0.16922800 -3.39826000 -2.54902300
H 1.37830600 -4.42994400 1.32968500
H 0.79803000 -5.09186700 -0.99932900
C 1.15979800 0.92920800 0.21208700
C 2.33634300 0.42862100 -0.35492300
C 1.06717900 2.31137900 0.44849900
C 3.39212600 1.28523500 -0.67852300
H 2.43105300 -0.63452000 -0.54499900
C 2.12072400 3.16709600 0.13121800
H 0.15045900 2.72495700 0.86307900
C 3.29049500 2.65504100 -0.43615100
H 4.29659200 0.87581600 -1.12080500
H 2.02523900 4.23325900 0.31955200
H 4.11210900 3.31957000 -0.68962000
O 0.04841900 -0.02642600 2.12052600
H 0.07579400 0.89209100 2.43137500
这是报错情况
Route card not found.
Error termination via Lnk1e in /public/software/apps/g09-D01/g09/g09/l1.exe at Fri Mar 12 01:56:16 2021.
Job cpu time: 0 days 0 hours 0 minutes 0.0 seconds.
File lengths (MBytes): RWF= 0 Int= 0 D2E= 0 Chk= 0 Scr= 0