! easymecp: with_freq=yes
%nprocshared=20
%mem=48GB
%chk=B-1-O2.chk
#p  freq=projected  guess(read) genecp iop(1/8=1) scrf=(smd,solvent=chloroform) nosymm
pop=full cphf=maxinv=12000 gfinput gfprint um06
scf=(maxcyc=400,xqc)

MECP

0 1
  78   -3.71301063    0.07800611    1.94273406
   6   -5.26933636   -1.23082557   -0.26779768
   6   -5.35994010    1.01128002   -0.39050658
   6   -6.11234755   -0.90065390   -1.42827300
   6   -6.17512822    0.49191346   -1.49992701
   6   -6.77348861   -1.70428365   -2.34243926
   6   -6.90447057    1.13314128   -2.48820000
   6   -7.51157631   -1.06551985   -3.34233878
   1   -6.71942966   -2.78999316   -2.28066083
   6   -7.57728898    0.32975947   -3.41271836
   1   -6.95251978    2.21970259   -2.54005068
   1   -8.04585342   -1.66286412   -4.07971601
   1   -8.16200118    0.79798255   -4.20291208
   7   -3.64115260   -1.99105198    2.05996339
   6   -4.23326951   -2.82744425    1.15814723
   6   -2.98134718   -2.52997113    3.11447591
   6   -4.09642962   -4.22231549    1.31272980
   6   -2.83921258   -3.88678585    3.30837627
   1   -2.55472304   -1.81520118    3.81305570
   6   -3.40349816   -4.75859300    2.37534379
   1   -4.56963712   -4.84851733    0.56030357
   1   -2.29161090   -4.24551431    4.17607242
   1   -3.30880217   -5.83707943    2.48656803
   7   -3.75683411    2.14766736    1.79931066
   6   -3.10944690    2.85067475    2.76067755
   6   -4.42081948    2.83060063    0.82107007
   6   -3.05399337    4.22739240    2.78760417
   1   -2.61603534    2.25500163    3.52430141
   6   -4.37263538    4.23951052    0.80344554
   6   -3.69511982    4.94247495    1.77508057
   1   -2.51298612    4.72305815    3.58939679
   1   -4.90040297    4.73814569   -0.00586626
   1   -3.66971767    6.03039257    1.75414651
   6   -5.15733564    0.16592729    3.68390074
   1   -4.54942321    0.40513839    4.56434097
   1   -5.88258251    0.95276821    3.45079320
   1   -5.63190258   -0.81817093    3.75909370
   7   -5.16958413    2.27427535   -0.18198677
   7   -4.98981295   -2.44471967    0.08251084
   7   -4.87079060   -0.05688640    0.31036257
   8   -1.08703149    0.19051248    2.69310591
   8   -2.22341410    0.20639515    3.36003773

-C -H -N -O
6-31+g(d)
******
Pt     0 
S   1   1.00
      2.5470000              1.0000000        
S   1   1.00
      1.6140000              1.0000000        
S   1   1.00
      0.5167000              1.0000000        
S   1   1.00
      0.2651000              1.0000000        
S   1   1.00
      0.0580000              1.0000000        
P   1   1.00
      2.9110000              1.0000000        
P   1   1.00
      1.8360000              1.0000000        
P   1   1.00
      0.5982000              1.0000000        
P   1   1.00
      0.0996000              1.0000000        
P   1   1.00
      0.0290000              1.0000000        
D   1   1.00
      1.2430000              1.0000000        
D   1   1.00
      0.4271000              1.0000000        
D   1   1.00
      0.1370000              1.0000000        
F   1   1.00
      0.9930000              1.0000000
****

PT     0
PT-ECP     4     60
g-ul potential
  5
1    728.9394056             -0.1619268        
2    320.6567800          -1320.2873852        
2     52.8680174           -298.3178135        
2     12.0280128            -87.5837065        
2      3.5238913             -8.1493274        
s-ul potential
  6
0    409.4437358              2.7334218        
1    274.5419231             59.7024329        
2    127.5658570            891.4589550        
2     32.9036631            368.4467656        
2      5.0593880            238.0263090        
2      4.1506556           -107.0556454        
p-ul potential
  4
0    466.1728892              1.8878568        
1    120.7888259             76.0138629        
2     36.4118791            343.5511116        
2      5.6985408            119.4911786        
d-ul potential
  5
0    249.5650763              2.9343678        
1    126.6678585             59.3306571        
2     63.1430586            452.4445194        
2     17.9059470            210.4769479        
2      4.2239373             58.6254112        
f-ul potential
  5
0    121.8158799              3.9534253        
1     60.8757030             53.8555182        
2     31.4767147            247.4305133        
2      9.8811751            127.8187976        
2      2.7319874             15.3772046





