%chk=Int3b2-trans.chk
%nprocshared=8
%mem=30GB
#p opt freq=noraman b97d3/gen pseudo=read nosymm

Int3b2-trans

-1 1
 N                  1.49875500   12.10634100   -0.21881600
 O                  3.06980900    9.87767300    0.02107700
 O                  0.36336800    9.57642600   -1.04647000
 O                  1.60053600   11.33775100   -2.91330500
 C                  2.75824600   12.79609400    0.19238000
 H                  3.26614700   13.08711600   -0.73713600
 H                  2.48832600   13.73348000    0.71648100
 C                  3.67341300   11.97402300    1.06448500
 C                  3.81559600   10.57453300    0.87536100
 C                  4.78233200    9.87608600    1.65999700
 C                  5.54518900   10.57684600    2.59801200
 H                  6.28455500   10.02393900    3.18658800
 C                  5.39571200   11.96061700    2.81297500
 C                  4.44835700   12.63335200    2.03274600
 H                  4.30893700   13.71073800    2.16903100
 C                  0.76352000   11.62094300    0.98995800
 H                  1.41466500   10.88688700    1.47742600
 H                  0.63278900   12.46739900    1.68882600
 C                 -0.57540200   11.01690500    0.66088100
 C                 -0.68647800   10.01528500   -0.34329700
 C                 -1.97876700    9.47339200   -0.61101800
 C                 -3.08372100    9.92088100    0.12271100
 H                 -4.06482200    9.49129500   -0.10378200
 C                 -2.98369900   10.90473600    1.12186700
 C                 -1.71393300   11.44503200    1.36014200
 H                 -1.59593800   12.22677000    2.11674900
 C                  0.63531100   13.07460900   -0.97190000
 H                 -0.28081500   12.52966600   -1.23274200
 H                  0.35368200   13.89996700   -0.29153500
 C                  1.30965100   13.59808700   -2.20473200
 C                  1.78771300   12.63707800   -3.13282300
 C                  2.47435700   13.09078800   -4.29326700
 C                  2.60779900   14.46935100   -4.50599500
 H                  3.13704100   14.80848800   -5.40305200
 C                  2.11603300   15.43159000   -3.60408000
 C                  1.48283800   14.96739200   -2.44065900
 H                  1.11357300   15.68490900   -1.70076100
 Al                 2.00226900   10.35241400   -1.41555500
 C                  4.67320639   10.06730144   -2.54928005
 O                  4.34018139   11.17273644   -2.17540805
 O                  5.54517839    9.33547444   -2.92759705
 C                 -4.19600500   11.34852800    1.91076600
 H                 -5.07556100   11.48697100    1.26134800
 H                 -4.48075200   10.61005500    2.68095800
 H                 -4.00885600   12.30163300    2.42807600
 C                 -2.14579100    8.42990300   -1.68595800
 H                 -1.71929300    8.76958700   -2.64116800
 H                 -1.62435100    7.49726700   -1.42543800
 H                 -3.20894800    8.19554500   -1.84335800
 C                  4.96066900    8.39427800    1.44857600
 H                  4.06566000    7.83596400    1.76499300
 H                  5.10976900    8.15473200    0.38637200
 H                  5.82034000    8.01349300    2.01954100
 C                  3.09572700   12.08107100   -5.22607200
 H                  4.17357500   11.97471400   -5.01902000
 H                  2.63923400   11.09884500   -5.07130500
 H                  2.98753400   12.37781200   -6.28159400
 C                  2.25765700   16.91190500   -3.88570500
 H                  3.23704300   17.14817300   -4.33191200
 H                  1.48895000   17.27610400   -4.59073000
 H                  2.15821800   17.50573400   -2.96404600
 C                  6.23442500   12.68527100    3.84326700
 H                  7.31083000   12.63856300    3.60379300
 H                  5.95755400   13.74851700    3.90557200
 H                  6.11514800   12.25188500    4.85109100
 O                  2.91541300    9.03407200   -2.48447800
 C                  3.19298800    7.64983500   -2.64195700
 H                  4.16700700    7.45372100   -2.17837500
 C                  2.16996600    6.70166500   -1.95323700
 C                  3.32693400    7.29925100   -4.13995600
 O                  2.66556100    5.28778400   -2.21061100
 C                  0.83058900    6.74423400   -2.68198000
 C                  1.99285500    6.87216500   -0.45085800
 C                  2.00623800    7.17646000   -4.95697400
 H                  3.87449500    6.34966800   -4.20414200
 H                  3.98395900    8.05295200   -4.58823800
 C                  3.83159600    4.87476800   -1.69705300
 C                  0.91434100    6.40696900   -4.17516800
 H                  0.45097500    7.75769700   -2.51932200
 H                  0.12872100    6.05542700   -2.18483800
 H                  2.95316400    6.93181800    0.06145800
 H                  1.42036600    7.78086500   -0.24880700
 H                  1.42403400    6.01204200   -0.06454500
 O                  4.58860900    5.46291400   -0.95004200
 O                  4.17342000    3.60976300   -2.09189600
 H                 -0.06399600    6.59008400   -4.64514100
 H                  1.11106500    5.33059300   -4.27270900
 C                  3.42766800    2.72112000   -3.00495300
 C                  4.51581700    1.62773600   -3.10814700
 C                  3.13649500    3.35573800   -4.39157800
 C                  2.15775900    2.25891600   -2.29000400
 H                  4.74242800    1.24086600   -2.11114800
 C                  5.79207200    2.07666200   -3.82956100
 Cl                 3.78447700    0.06923400   -3.95837200
 C                  4.11264200    2.95363600   -5.50688400
 H                  3.14378000    4.43955900   -4.26980300
 H                  2.11367900    3.08568300   -4.68943900
 H                  2.40491600    1.84307800   -1.30282300
 H                  1.48868700    3.11700100   -2.15729000
 H                  1.64386400    1.49026400   -2.87927100
 C                  5.58468500    3.03574600   -5.03910000
 H                  6.32913900    1.17548800   -4.15195900
 H                  6.42353600    2.55163100   -3.06880700
 H                  3.90802300    1.92820000   -5.83944200
 H                  3.94877600    3.60570200   -6.37556500
 C                  6.02303500    4.49023500   -4.84282500
 H                  6.19905000    2.65013000   -5.87216200
 C                  6.43516900    5.04054300   -3.68817000
 C                  5.96139700    5.33788700   -6.09907000
 H                  6.45429100    4.50933900   -2.74017200
 H                  6.71728800    6.09371600   -3.64422100
 H                  6.42736100    4.82330600   -6.95691900
 H                  4.92172200    5.56118000   -6.38843500
 H                  6.46766300    6.30022900   -5.95063500
 C                  1.55856600    8.50481400   -5.55474800
 C                  0.54728800    9.25087100   -5.08474100
 C                  2.34520300    8.93414200   -6.77405700
 H                  0.28418100   10.20354800   -5.54558300
 H                 -0.00823700    8.98869000   -4.18792100
 H                  3.41497500    9.05820200   -6.53797600
 H                  2.28573900    8.17087700   -7.57082200
 H                  1.98227500    9.88768700   -7.17966200
 H                  2.26121100    6.54379200   -5.82914300
   
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        


