! easymecp: with_freq=yes
%nprocshared=24
%mem=120GB
%chk=MECP_attempt_2-1.chk
#p  freq=projected  guess(read) scrf=(smd,solvent=dichloromethane) nosymm pop=full gfinput gfprint ub3lyp genecp empiricaldispersion=gd3 scf=(maxcyc=400,xqc) int=grid=ultrafine pseudo=read

MECP_attempt_2

0 1
  29   -0.64308412   -0.39415475   -1.58130017
   7    1.31731447   -1.28082457   -2.51091675
   7    2.45781754   -0.84094434   -1.90735120
   7    0.35581188    1.42284965   -1.41627533
   7    1.65494048    1.40258860   -1.00147500
   7    0.22534658   -1.00696252    0.21414527
   7    1.53220691   -0.67204047    0.43084627
   5    2.36379113    0.06760072   -0.65817646
   6    1.68294750   -2.17873333   -3.41547466
   6    3.08317815   -2.34523189   -3.42977699
   6    3.53311913   -1.46907012   -2.44706827
   6    0.03214946    2.69471675   -1.64860681
   6    1.12417185    3.53791836   -1.37874778
   6    2.13440212    2.66803265   -0.97209263
   6   -0.18310312   -1.70742762    1.27336217
   6    0.85600204   -1.83705517    2.21155322
   6    1.92727725   -1.16406768    1.62772898
   1    3.44562241    0.29406676   -0.24203661
   7   -1.89660723   -0.61644121   -2.96729995
  16   -3.54162316   -0.36718258   -3.10782157
   8   -4.06292849   -1.43506929   -3.98381642
   8   -3.82658065    1.03105348   -3.48165778
   6   -4.13185738   -0.63984173   -1.44480496
   6   -4.73107552   -1.85771993   -1.12980890
   6   -4.03387158    0.38928864   -0.50229025
   6   -5.23909551   -2.04606999    0.15673445
   1   -4.80832171   -2.63805740   -1.87915997
   6   -4.53964507    0.18005947    0.77662933
   1   -3.58251624    1.33788297   -0.77129692
   6   -5.15191633   -1.03668573    1.12538894
   1   -5.71548998   -2.98985158    0.40672010
   1   -4.46627002    0.97345977    1.51579283
   6   -5.68191708   -1.24853504    2.52037964
   1   -4.86541201   -1.23689147    3.25249436
   1   -6.37626711   -0.45038508    2.80433070
   1   -6.20351754   -2.20506434    2.61177504
  35   -1.93598962   -2.38022958    1.38464756
  35   -1.66394922    3.14824986   -2.30591810
  35    0.40375965   -3.05481271   -4.49037318
  35    4.11080219   -3.45338835   -4.55185108
  35    5.30900924   -1.13302421   -1.92322332
  35    3.65888465   -0.94152422    2.32880068
  35    0.81138595   -2.71461065    3.87491854
  35    1.21993668    5.40494388   -1.58420866
  35    3.89468688    3.10686042   -0.48085229
   1   -1.51790608   -0.61069587   -3.93582442
  14   -0.68871990    0.41397315   -6.06871593
   6   -1.89326691    1.85708356   -6.25163151
   6   -0.61245859   -0.69129414   -7.59968350
   6    1.01202253    0.97645546   -5.51616010
   1   -2.87103285    1.49624681   -6.58704885
   1   -2.04478598    2.37084411   -5.29859732
   1   -1.52816747    2.58716148   -6.98604208
   1    0.08141408   -1.52601697   -7.45951622
   1   -1.60140544   -1.10870274   -7.81881459
   1   -0.28426421   -0.12416533   -8.48066342
   6    1.19803235    2.19565021   -4.82964670
   6    2.14986357    0.17037729   -5.73282109
   6    2.46080495    2.59123717   -4.38647483
   1    0.34926814    2.84970172   -4.64935981
   6    3.41178299    0.55934895   -5.28401584
   1    2.05025354   -0.77413097   -6.26116392
   6    3.57150112    1.77179380   -4.60653602
   1    2.58190743    3.54151445   -3.87511364
   1    4.27073798   -0.08041623   -5.46499913
   1    4.55406338    2.07857592   -4.25928691

-Cu 0
LANL2DZ
****
-Br 0
LANL2DZ
P 1 1.000
0.03760 1.000
D 1 1.000
0.43400 1.000
****
-C -N -H -B -O -S -Si 0
6-31G(d,p)
****

-Cu -Br 0
LANL2DZ






