%nprocshared=12
%mem=20GB
#p b3lyp/genecp EmpiricalDispersion=GD3 scrf=(smd,solvent=toluene) 

TS GH8

0 1
 Ru                -0.46909800    0.25365400    0.41023400
 C                 -0.20733700   -1.75927400   -0.02206800
 N                 -1.25445300   -2.54611800   -0.34640400
 N                  0.89342000   -2.52693800    0.06832300
 C                 -0.90560700   -3.98094800   -0.35563900
 H                 -1.29127400   -4.46099000   -1.25843900
 H                 -1.34643700   -4.47065300    0.52009300
 C                  0.62449500   -3.93743100   -0.29822100
 H                  1.09130400   -4.15953600   -1.26459300
 H                  1.04513400   -4.60895600    0.45303600
 Cl                -0.59114900   -0.41900400    2.77431900
 Cl                -0.33098600    0.95653100   -1.91644000
 C                  2.25838500   -2.12716800    0.27376400
 C                  2.83989700   -2.32224200    1.54118000
 C                  3.01906300   -1.69371000   -0.82582400
 C                  4.19603900   -2.02038900    1.69720200
 C                  4.37789500   -1.42693500   -0.62268600
 C                  4.98177800   -1.57333200    0.62890300
 H                  4.65446000   -2.15992400    2.67397600
 H                  4.97796100   -1.09603900   -1.46741000
 C                 -2.60793200   -2.12260200   -0.57285300
 C                 -3.53699700   -2.13443300    0.48385300
 C                 -2.99778000   -1.81585600   -1.89284800
 C                 -4.84938700   -1.72806800    0.20975400
 C                 -4.31949900   -1.42248500   -2.11465000
 C                 -5.25530300   -1.35486300   -1.07432200
 H                 -5.57174000   -1.71440200    1.02312900
 H                 -4.62801700   -1.16795600   -3.12606900
 C                  2.39990600   -1.49850800   -2.18519700
 H                  1.78293700   -2.35221100   -2.48831600
 H                  1.75120800   -0.61647200   -2.18922000
 H                  3.17306200   -1.36099800   -2.94821900
 C                  2.04655600   -2.88825900    2.69147100
 H                  1.09533900   -2.36533000    2.81643100
 H                  1.82583800   -3.95331200    2.53466600
 H                  2.60818100   -2.80701800    3.62750000
 C                  6.44334600   -1.25126300    0.83255000
 H                  6.57176500   -0.25527200    1.27712600
 H                  6.92137700   -1.96794900    1.51039600
 H                  6.99380800   -1.26277300   -0.11439500
 C                 -2.02570800   -1.94212600   -3.03767600
 H                 -2.52288200   -1.74325100   -3.99217800
 H                 -1.19908800   -1.23437600   -2.93093700
 H                 -1.59714900   -2.95135000   -3.08631400
 C                 -3.17778000   -2.63753700    1.85933200
 H                 -3.38543300   -3.71423700    1.93485000
 H                 -2.12826100   -2.46975800    2.10175700
 H                 -3.77605500   -2.13715000    2.62752200
 C                 -6.66101500   -0.87018900   -1.33419100
 H                 -7.00929500   -1.16081400   -2.33168000
 H                 -7.36765700   -1.26491300   -0.59621000
 H                 -6.70983900    0.22581400   -1.28019400
 C                 -2.07140700    1.54031700    0.91385200
 H                 -2.45840000    1.15797700    1.85814900
 C                 -3.13831900    1.62103600   -0.16429000
 H                 -3.50391500    0.60450400   -0.33572900
 C                 -4.34865800    2.49216200    0.23055700
 H                 -5.16019000    2.25360900   -0.47078800
 H                 -4.70668400    2.19257400    1.22670100
 C                 -4.12450000    4.01404000    0.20877100
 H                 -5.10564200    4.48889800    0.34003500
 C                 -3.15829200    4.56343700    1.28345100
 H                 -3.12697000    3.86641500    2.13243400
 H                 -3.56509800    5.49896000    1.68878300
 C                 -1.72741900    4.86722600    0.80654100
 H                 -1.15091600    5.24065100    1.66471000
 H                 -1.34781400    3.46367500   -0.82858500
 C                 -0.98184500    2.49289700    1.05358200
 H                 -0.72211600    2.69057400    2.09298000
 C                  0.86507800    1.44640800    0.95573500
 H                  1.13655700    1.48231900    2.01701100
 C                 -0.93937700    3.70924800    0.15282100
 H                  0.08360900    4.04861400   -0.00301500
 C                  1.89608100    2.16930500    0.13219200
 O                  2.61162100    1.32693000   -0.61761300
 O                  2.11706700    3.36432300    0.22493000
 C                  3.67234400    1.89378200   -1.42071500
 H                  3.86695400    1.13352900   -2.17870800
 C                  4.92365400    2.17002400   -0.58348700
 C                  6.05493300    2.65585400   -1.44706300
 C                  7.20405500    2.00393200   -1.63341500
 H                  5.89091800    3.60596800   -1.95840700
 H                  7.98887300    2.39698900   -2.27556200
 H                  7.40860400    1.05510400   -1.13997800
 H                  4.67032900    2.92417600    0.17128500
 H                  3.30454400    2.80205000   -1.90702900
 H                 -1.76104500    5.68928100    0.07831300
 H                 -3.77821300    4.31321800   -0.79119800
 H                 -2.72725300    1.96105200   -1.11563700
 H                  5.20289200    1.25004400   -0.06049900

-O -N -C -H -Cl 0
cc-pvTZ
****
Ru     0
S    9   1.00
    208.2500000              0.0005230
     18.8471000             -0.0449130
     11.7818000              0.2576260
      7.3619500             -0.2091300
      4.2777100             -0.5106620
      1.1910700              0.8032470
      0.5485680              0.4984140
      0.1386940              0.0337660
      0.0676510             -0.0120940
S    9   1.00
    208.2500000             -0.0001750
     18.8471000              0.0148030
     11.7818000             -0.0875270
      7.3619500              0.0842820
      4.2777100              0.1549110
      1.1910700             -0.3381410
      0.5485680             -0.3160050
      0.1386940              0.2835260
      0.0676510              0.6092730
S    9   1.00
    208.2500000             -0.0001820
     18.8471000              0.0052730
     11.7818000             -0.0785570
      7.3619500             -0.0138970
      4.2777100              0.5479870
      1.1910700             -1.4980850
      0.5485680              0.4795000
      0.1386940              2.1402540
      0.0676510             -1.4545610
S    9   1.00
    208.2500000             -0.0006350
     18.8471000              0.0517470
     11.7818000             -0.3171890
      7.3619500              0.3298480
      4.2777100              0.6270530
      1.1910700             -3.4222090
      0.5485680              3.8479480
      0.1386940             -1.6239260
      0.0676510             -0.6032230
S    1   1.00
      0.0301410              1.0000000
P    8   1.00
     22.7753000             -0.0015440
     14.2340000              0.0257710
      5.9875500             -0.1865980
      1.6392400              0.4427740
      0.8278800              0.4781510
      0.4090100              0.2083690
      0.1718770              0.0246350
      0.0712710             -0.0002190
P    8   1.00
     22.7753000             -0.0001480
     14.2340000             -0.0091740
      5.9875500              0.0813740
      1.6392400             -0.2361250
      0.8278800             -0.2943330
      0.4090100              0.0150980
      0.1718770              0.6560890
      0.0712710              0.4389440
P    8   1.00
     22.7753000             -0.0000630
     14.2340000             -0.0114610
      5.9875500              0.0999930
      1.6392400             -0.3036410
      0.8278800             -0.3638860
      0.4090100              0.1659350
      0.1718770              0.7005450
      0.0712710              0.3189430
P    8   1.00
     22.7753000              0.0011030
     14.2340000             -0.0225190
      5.9875500              0.1821610
      1.6392400             -0.7313300
      0.8278800             -0.4901170
      0.4090100              1.5235390
      0.1718770             -0.0391820
      0.0712710             -0.8661830
P    1   1.00
      0.0292260              1.0000000
D    7   1.00
     25.8838000              0.0015230
      7.5925500             -0.0181620
      2.7129300              0.1096910
      1.3970800              0.2915970
      0.6825650              0.3620440
      0.3193780              0.2975140
      0.1417810              0.1610370
D    7   1.00
     25.8838000             -0.0015510
      7.5925500              0.0190350
      2.7129300             -0.1257740
      1.3970800             -0.3632850
      0.6825650             -0.2793510
      0.3193780              0.2457120
      0.1417810              0.5472610
D    7   1.00
     25.8838000              0.0026560
      7.5925500             -0.0337600
      2.7129300              0.2929230
      1.3970800              0.6173710
      0.6825650             -0.3625300
      0.3193780             -0.8031580
      0.1417810              0.3154610
D    1   1.00
      0.0580170              1.0000000
F    1   1.00
      1.6965000              1.0000000
F    1   1.00
      0.4754000              1.0000000
G    1   1.00
      1.0311000              1.0000000
****

RU     0
RU-ECP     4     28
g potential
  1
2      1.0000000              0.0000000
s-g potential
  2
2     11.50059000           209.78649300
2      5.06857500            30.21430700
p-g potential
  4
2     10.53263400            48.75124400
2     10.19201000            97.49652900
2      4.73489200             7.86018800
2      4.50906500            15.32975100
d-g potential
  4
2      8.87797700            26.96750600
2      8.76612200            40.43230300
2      3.17019600             3.34075800
2      3.22885100             5.25635200
f-g potential
  2
2      7.82024900            -8.84752500
2      7.83964700           -11.83551800





