%chk=LO-ts2b2-cis.chk
%nprocshared=12
%mem=22GB
#p opt=(TS,CalcFC,noeigentest) freq=noraman b97d3/gen pseudo=read nosymm iop(1/8=5)

LO-ts2b2-cis

-1 1
 N                  1.63047000   12.16340700   -0.10344300
 O                  3.49402800   10.21034400    0.25086400
 O                  1.18192100    9.31384800   -0.96632300
 O                  1.66483500   11.35086900   -2.79843800
 C                  2.74402300   13.02391000    0.41874900
 H                  3.26249600   13.41127700   -0.47022600
 H                  2.29594800   13.89624400    0.92385400
 C                  3.70189400   12.33251500    1.35763200
 C                  4.05836500   10.97225900    1.16826700
 C                  5.02222100   10.39268100    2.04438000
 C                  5.58146000   11.16614100    3.05932400
 H                  6.32179100   10.70541600    3.71977900
 C                  5.22540800   12.51186800    3.26740400
 C                  4.27859200   13.06777500    2.40350600
 H                  3.97829400   14.11083900    2.53904600
 C                  0.90268900   11.49163800    1.02526800
 H                  1.65285600   10.93879800    1.59341600
 H                  0.50072700   12.27608700    1.68593300
 C                 -0.20544000   10.56696400    0.58872200
 C                  0.02800100    9.49678400   -0.32324200
 C                 -1.03378100    8.57068200   -0.54432400
 C                 -2.26460400    8.75682400    0.08588400
 H                 -3.06148700    8.03441000   -0.11140900
 C                 -2.52009400    9.83486200    0.94815200
 C                 -1.46740700   10.72110700    1.18244700
 H                 -1.61875100   11.56284600    1.86354100
 C                  0.65967900   13.01959900   -0.86493200
 H                 -0.18567400   12.36436200   -1.10356700
 H                  0.29569600   13.81256500   -0.19117200
 C                  1.23883200   13.58818200   -2.12307700
 C                  1.70732000   12.65135600   -3.07509900
 C                  2.20580400   13.12652700   -4.31674300
 C                  2.22156500   14.50313600   -4.55359500
 H                  2.61810000   14.86207600   -5.50768800
 C                  1.77089600   15.44492000   -3.61007600
 C                  1.28506000   14.96078800   -2.39023100
 H                  0.92553100   15.66234500   -1.63235400
 Al                 2.46327900   10.61761100   -1.26102200
 C                  4.55072000    9.56736300   -2.85881500
 O                  4.13070400   10.59560400   -2.20895500
 O                  5.64629800    9.36097400   -3.34910800
 O                  3.48398400    8.65213800   -2.94237400
 C                  3.60966600    7.32563800   -3.53567000
 C                  2.10900800    6.96814400   -3.55555200
 C                  4.17341000    7.36105600   -4.96331500
 C                  1.29526600    7.81450300   -4.51944300
 C                  3.39055300    8.30879900   -5.87829800
 H                  5.21812800    7.67547100   -4.91478000
 H                  4.14998600    6.33223100   -5.34172500
 C                  1.87249100    8.03276100   -5.94580100
 H                  0.27466100    7.42264000   -4.58467800
 H                  1.23338900    8.79643000   -4.03195400
 H                  1.40206300    8.96529100   -6.28894000
 Cl                 1.86768000    5.11132400   -3.91005700
 C                 -3.87785000   10.02467000    1.58356200
 H                 -4.64782900   10.28269300    0.83979600
 H                 -4.22169400    9.11273600    2.09378300
 H                 -3.86058800   10.83155200    2.32767600
 C                 -0.80723900    7.39928200   -1.46006900
 H                 -0.56602100    7.73238400   -2.47542400
 H                  0.03800400    6.78548000   -1.12257700
 H                 -1.69497000    6.75683300   -1.51156500
 C                  5.39941200    8.95195100    1.82447800
 H                  4.52286500    8.29566600    1.91543800
 H                  5.78333800    8.80023300    0.80682200
 H                  6.16162900    8.62363300    2.54290700
 C                  2.74117500   12.12979200   -5.30830600
 H                  3.63242700   11.63244600   -4.90479700
 H                  2.00764900   11.33788800   -5.50607000
 H                  3.00879200   12.60860000   -6.25872500
 C                  1.81772800   16.92535900   -3.91280000
 H                  2.83745400   17.26200900   -4.15298300
 H                  1.18463100   17.18913500   -4.77389000
 H                  1.46978000   17.51847000   -3.05723100
 C                  5.85205100   13.31714500    4.38239500
 H                  6.93607100   13.44551600    4.23788100
 H                  5.41085900   14.32033300    4.44616000
 H                  5.71760000   12.83564200    5.36297800
 H                  3.53141200    9.32818500   -5.50422500
 C                  4.44107400    6.45163800   -2.60049800
 H                  5.44379200    6.88162700   -2.51655500
 H                  3.98301500    6.42515500   -1.60467800
 H                  4.51827200    5.42820400   -2.98065800
 H                  1.71366300    7.05725500   -2.54631500
 H                  3.82264100    8.29707600   -6.88891800
 C                  1.43634800    6.97979600   -6.96816900
 C                  0.23716700    7.10445900   -7.55884500
 H                 -0.43208000    7.93400400   -7.32460600
 H                 -0.12627600    6.37328100   -8.28241100
 C                  2.34533800    5.83237100   -7.33208700
 H                  3.32317700    6.18960400   -7.68364400
 H                  2.53009600    5.18519600   -6.46853900
 H                  1.90277400    5.22267600   -8.12933900
   
C,H,O,N 0
6-311G**
****
Al     0 
S   2   1.00
      0.9615000             -0.5021546        
      0.1819000              1.2342547        
S   1   1.00
      0.0657000              1.0000000        
P   2   1.00
      1.9280000             -0.0712584        
      0.2013000              1.0162966        
P   1   1.00
      0.0580000              1.0000000        
****
Cl     0 
S   2   1.00
      2.2310000             -0.4900589        
      0.4720000              1.2542684        
S   1   1.00
      0.1631000              1.0000000        
P   2   1.00
      6.2960000             -0.0635641        
      0.6333000              1.0141355        
P   1   1.00
      0.1819000              1.0000000        
****

AL     0
AL-ECP     2     10
d   potential
  5
1    304.7291926            -10.0000000        
2     61.5299768            -63.8079837        
2     13.9259006            -22.8972174        
2      4.1463626             -8.0063232        
2      1.3715443             -0.8829345        
s-d potential
  5
0    467.8437756              3.0000000        
1     79.3992216             50.9705682        
2     25.4035967            143.8716460        
2      6.9954696             48.0055753        
2      1.7860129             14.0114180        
p-d potential
  6
0    776.2717190              5.0000000        
1    118.4992254             93.0595424        
2     34.4107276            266.7686329        
2      8.7859563             70.0725805        
2      2.3406228             17.2290839        
2      0.7398386              0.7105331        
CL     0
CL-ECP     2     10
d   potential
  5
1     94.8130000            -10.0000000        
2    165.6440000             66.2729170        
2     30.8317000            -28.9685950        
2     10.5841000            -12.8663370        
2      3.7704000             -1.7102170        
s-d potential
  5
0    128.8391000              3.0000000        
1    120.3786000             12.8528510        
2     63.5622000            275.6723980        
2     18.0695000            115.6777120        
2      3.8142000             35.0606090        
p-d potential
  6
0    216.5263000              5.0000000        
1     46.5723000              7.4794860        
2    147.4685000            613.0320000        
2     48.9869000            280.8006850        
2     13.2096000            107.8788240        
2      3.1831000             15.3439560        


