!  s3-21G  EMSL  Basis Set Exchange Library   7/29/18 8:12 AM
! Elements                             References
! --------                             ----------
! Sc-Zn: M. Swart, M. Gell, J.M. Luis and M. Sola, Spin-state corrected Gaussian-type orbital basis sets, J. Phys. Chem. A 114, 7191?7197 (2010).
! 



$DATA
SCANDIUM
S   3
  1   2119.887000000            0.06442100       
  2    320.429900000            0.37916000       
  3     69.898930000            0.67896300       
L   3
  1     89.764500000           -0.10938400             0.13632800       
  2     19.385100000            0.10507000             0.54186000       
  3      5.731423000            0.95220500             0.49505500       
L   3
  1      5.491938000           -0.28521100             0.01761400       
  2      1.743742000            0.32415500             0.43364500       
  3      0.566227000            0.85659200             0.64255100       
L   2
  1      0.516802000           -0.26267800             0.00032700       
  2      0.067214000            1.10807900             0.99989300       
L   1
  1      0.025985000            1.00000000             1.00000000       
D   2
  1      5.722215000            0.26523600       
  2      1.360849000            0.85586100       
D   1
  1      0.322652000            1.0000000        
D   1
  1      0.076620000            1.0000000        

TITANIUM
S   3
  1   2335.020000000            0.06421700       
  2    353.044100000            0.37841200       
  3     77.058450000            0.67968100       
L   3
  1     99.573870000           -0.10947200             0.13729700       
  2     21.546710000            0.10194300             0.54587500       
  3      6.413965000            0.95462200             0.48906800       
L   3
  1      6.238279000           -0.28613700             0.01923700       
  2      1.996108000            0.32182800             0.44044200       
  3      0.646490000            0.85955100             0.63562000       
L   2
  1      0.573285000           -0.24245000             0.00029200       
  2      0.073119000            1.10007500             0.99990700       
L   1
  1      0.026538000            1.00000000             1.00000000       
D   2
  1      7.083666000            0.26292100       
  2      1.709634000            0.85577200       
D   1
  1      0.414123000            1.0000000        
D   1
  1      0.100130000            1.0000000        

VANADIUM
S   3
  1   2563.877000000            0.06394800       
  2    387.534000000            0.37759400       
  3     84.598230000            0.68054200       
L   3
  1    109.793800000           -0.10983600             0.13842100       
  2     23.769210000            0.10070700             0.55048900       
  3      7.122961000            0.95563300             0.48241700       
L   3
  1      6.981204000           -0.28845900             0.02182100       
  2      2.219839000            0.33643600             0.45676200       
  3      0.719803000            0.84819000             0.61867500       
L   2
  1      0.631262000           -0.23649000             0.00019000       
  2      0.080062000            1.09772100             0.99994000       
L   1
  1      0.028865000            1.00000000             1.00000000       
D   2
  1      8.342917000            0.26406200       
  2      2.032944000            0.85396600       
D   1
  1      0.495712000            1.0000000        
D   1
  1      0.120830000            1.0000000        

CHROMIUM
S   3
  1   2798.294000000            0.06382400       
  2    423.137000000            0.37708400       
  3     92.438860000            0.68098900       
L   3
  1    120.280600000           -0.11777900             0.13987800       
  2     26.037270000            0.10143100             0.55598300       
  3      7.844172000            0.95719800             0.47481800       
L   3
  1      7.793276000           -0.28885700             0.02218500       
  2      2.497196000            0.33511500             0.46162500       
  3      0.805142000            0.85024800             0.61453900       
L   2
  1      0.703921000           -0.23225100             0.00018000       
  2      0.086162000            1.09367100             0.99994500       
L   1
  1      0.032199000            1.00000000             1.00000000       
D   2
  1      9.625339000            0.26559600       
  2      2.362264000            0.85215600       
D   1
  1      0.577094000            1.0000000        
D   1
  1      0.141310000            1.0000000        

MANGANESE
S   3
  1   3041.686000000            0.06374500       
  2    460.090100000            0.37674900       
  3    100.595800000            0.68124700       
L   3
  1    131.767300000           -0.11029600             0.14045400       
  2     28.569150000            0.09819000             0.55780200       
  3      8.660501000            0.95765900             0.47150100       
L   3
  1      8.569081000           -0.29171400             0.02422400       
  2      2.768178000            0.34396300             0.46866000       
  3      0.887288000            0.84519800             0.60742100       
L   2
  1      0.767443000           -0.23000400             0.00030800       
  2      0.092025000            1.09145000             0.99990700       
L   1
  1      0.033265000            1.00000000             1.00000000       
D   2
  1     11.068840000            0.26527200       
  2      2.730707000            0.85179500       
D   1
  1      0.668509000            1.0000000        
D   1
  1      0.164290000            1.0000000        

IRON
S   3
  1   3299.184000000            0.06358600       
  2    499.088600000            0.37620200       
  3    109.161400000            0.68178500       
L   3
  1    143.465200000           -0.11055200             0.14110100       
  2     31.168580000            0.09684700             0.56038700       
  3      9.483612000            0.95879700             0.46764400       
L   3
  1      9.464565000           -0.29205600             0.02376200       
  2      3.100373000            0.33752400             0.46891100       
  3      0.986493000            0.85194200             0.60831100       
L   2
  1      0.853412000           -0.22794400            -0.00042600       
  2      0.098812000            1.08828700             1.00012400       
L   1
  1      0.036442000            1.00000000             1.00000000       
D   2
  1     12.354490000            0.26861100       
  2      3.055605000            0.84927200       
D   1
  1      0.738591000            1.0000000        
D   1
  1      0.180600000            1.0000000        

COBALT
S   3
  1   3564.762000000            0.06348700       
  2    539.390800000            0.37581800       
  3    118.044900000            0.68212200       
L   3
  1    155.438200000           -0.11098700             0.14206400       
  2     33.815610000            0.09676700             0.56344400       
  3     10.333230000            0.95899200             0.46302400       
L   3
  1     10.381520000           -0.29226200             0.02631300       
  2      3.382714000            0.34325100             0.47691700       
  3      1.076954000            0.84696300             0.59915400       
L   2
  1      0.909015000           -0.21746000             0.00022800       
  2      0.105041000            1.08499800             0.99993400       
L   1
  1      0.037257000            1.00000000             1.00000000       
D   2
  1     13.740700000            0.27095500       
  2      3.408983000            0.84734200       
D   1
  1      0.818641000            1.0000000        
D   1
  1      0.199850000            1.0000000        

NICKEL
S   3
  1   3848.005000000            0.06326600       
  2    582.030700000            0.37517100       
  3    127.367400000            0.68282400       
L   3
  1    168.289600000           -0.11111500             0.14249000       
  2     36.656330000            0.09532400             0.56554700       
  3     11.232120000            0.96016100             0.45999300       
L   3
  1     11.358770000           -0.29206000             0.02613800       
  2      3.738846000            0.33754100             0.47659800       
  3      1.182463000            0.85253300             0.60038000       
L   2
  1      0.988904000           -0.21368700             0.00029400       
  2      0.111025000            1.08193300             0.99991700       
L   1
  1      0.039258000            1.00000000             1.00000000       
D   2
  1     15.220690000            0.27260600       
  2      3.786020000            0.84592800       
D   1
  1      0.904557000            1.0000000        
D   1
  1      0.220560000            1.0000000        

COPPER
S   3
  1   4134.302000000            0.06318800       
  2    625.491200000            0.37484500       
  3    136.955600000            0.68310000       
L   3
  1    181.496000000           -0.11132000             0.14308400       
  2     39.574310000            0.09448700             0.56775600       
  3     12.162460000            0.96087900             0.45671400       
L   3
  1     12.351110000           -0.29222300             0.02772700       
  2      4.049651000            0.34299100             0.48352400       
  3      1.279225000            0.84794600             0.59297800       
L   2
  1      1.049804000           -0.20650800             0.00013900       
  2      0.116933000            1.07927300             0.99996100       
L   1
  1      0.000751000            1.00000000             1.00000000       
D   2
  1     16.759380000            0.27411200       
  2      4.178977000            0.84462500       
D   1
  1      0.994327000            1.0000000        
D   1
  1      0.242260000            1.0000000        

ZINC
S   3
  1   4432.288000000            0.06309300       
  2    670.660100000            0.37450400       
  3    146.902400000            0.68341600       
L   3
  1    195.004200000           -0.11162800             0.14380600       
  2     42.568890000            0.09433600             0.57000200       
  3     13.121430000            0.96110000             0.45331200       
L   3
  1     13.402310000           -0.29178100             0.02870500       
  2      4.399906000            0.34261400             0.48625200       
  3      1.385148000            0.84828400             0.59023500       
L   2
  1      1.121558000           -0.20237100             0.00034400       
  2      0.122944000            1.07703500             0.99990500       
L   1
  1      0.042193000            1.00000000             1.00000000       
D   2
  1     18.368200000            0.27538600       
  2      4.591304000            0.84347700       
D   1
  1      1.090203000            1.0000000        
D   1
  1      0.265690000            1.0000000        
$END

