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%chk=D:\work\CrSCN\CrSCN.chk
#p opt b3lyp/gen scrf=(solvent=dmso) geom=connectivity

CrSCN

-3 2
Cr                 0.77697857    1.41325534    0.00000000
C                  3.87817857    1.41325534    0.00000000
N                  5.03817857    1.41325534    0.00000000
C                  0.77697857    4.51445534    0.00000000
N                  0.77697857    5.67445534    0.00000000
C                  0.77697857    1.41325534   -3.10120000
N                  0.77697857    1.41325534   -4.26120000
C                 -2.32422143    1.41325534    0.00000000
N                 -3.48422143    1.41325534    0.00000000
C                  0.77697857   -1.68794466    0.00000000
N                  0.77697857   -2.84794466    0.00000000
C                  0.77697857    1.41325534    3.10120000
N                  0.77697857    1.41325534    4.26120000
S                  2.67697857    1.41325534    0.00000000
S                  0.77697857    3.31325534    0.00000000
S                  0.77697857    1.41325534   -1.90000000
S                 -1.12302143    1.41325534    0.00000000
S                  0.77697857   -0.48674466    0.00000000
S                  0.77697857    1.41325534    1.90000000

1 14 1.0 15 1.0 16 1.0 17 1.0 18 1.0 19 1.0
2 3 3.0 14 1.0
3
4 5 3.0 15 1.0
5
6 7 3.0 16 1.0
7
8 9 3.0 17 1.0
9
10 11 3.0 18 1.0
11
12 13 3.0 19 1.0
13
14
15
16
17
18
19

Cr 0
lanl2d2
****
C N S 0
6-31g(d)
****

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(Enter C:\G09W\l301.exe)
General basis read from cards:  (5D, 7F)
Centers:   1
lanl2d2
QPErr --- A syntax error was detected in the input line.
lanl2d2
'
Last state="Top"
TCursr= 1018 LCursr=    0
Error reading general basis specification.
Error termination via Lnk1e in C:\G09W\l301.exe at Tue Nov 10 15:59:38 2015.

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1. QPErr --- A syntax error was detected in the input line.
lanl2d2
Ó¦¸ÃÊÇlanl2dz
2. scrf=(solvent=dmso)
Ó¦¸ÃÊÇ scrf=(solvent=DiMethylSulfoxide)
3. b3lyp/gen
Ó¦¸ÃÊÇ b3lyp/genecp
4. Cr 0
lanl2d2
****
C N S 0
6-31g(d)
****
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Cr 0
lanl2dz
****
C N S 0
6-31g(d)

Cr 0
lanl2dz
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