%nproc=24
%mem=120GB
#p freq=NoRaman SCRFDef=AsymmetricIEFPCM B3LYP gen pseudo=read empiricaldispersion=GD3 nosymm scf=xqc SCRF=(SMD,solvent=n-Hexane)

Ag Carbene - Alcane -- PROJECT

0 1
 7            -1.550910    2.191082   -0.729757
 7            -2.753186    1.674051   -0.422104
 7            -1.464842   -0.871559   -0.534420
 7            -2.462710   -0.711693    0.354070
 7            -0.692940    1.018008    1.928146
 7            -2.017755    1.223835    1.948033
 5            -2.917864    0.707787    0.787408
 6            -1.718285    2.959244   -1.804045
 6            -3.063501    2.942728   -2.219673
 6            -3.693823    2.100748   -1.307622
 6            -1.344423   -2.178733   -0.753760
 6            -2.280908   -2.898531    0.014064
 6            -2.978637   -1.918864    0.713127
 6            -0.175779    1.676087    2.965747
 6            -1.190701    2.334374    3.689223
 6            -2.359673    2.016169    2.999908
 1            -4.044932    0.683641    1.134224
 6            -0.339892   -2.699059   -1.736860
 9             0.365521   -1.693892   -2.293039
 9            -0.939694   -3.380610   -2.733512
 6            -0.549637    3.680755   -2.401280
 9             0.556666    3.531258   -1.635827
 9            -0.784401    4.997898   -2.529009
 6             1.314284    1.699040    3.094164
 9             1.845278    0.459138    2.940767
 9             1.736154    2.181722    4.266475
 9             1.868890    2.464028    2.110681
 9             0.536741   -3.541545   -1.148817
 9            -0.242873    3.205035   -3.632244
 6            -3.791026    2.406275    3.241604
 6            -4.123617   -2.016224    1.678547
 6            -5.126392    1.664055   -1.189623
35            -3.786801    3.886887   -3.688503
35            -0.993541    3.392545    5.245233
35            -2.497471   -4.776075    0.031694
 9            -3.905131    3.242120    4.284649
 9            -4.305625    3.030422    2.158000
 9            -4.560227    1.328070    3.491208
 9            -5.709908    2.176392   -0.087599
 9            -5.844712    2.052747   -2.254294
 9            -5.212943    0.317267   -1.103860
 9            -3.868993   -1.303731    2.800016
 9            -4.350164   -3.287049    2.045189
 9            -5.262329   -1.530848    1.143146
 6             2.737791    1.066015   -2.123627
 8             2.407524    0.594090   -3.195944
 8             3.212775    2.324476   -1.978072
 6             3.217551    3.115888   -3.170840
 1             2.221846    3.164924   -3.613611
 1             3.924077    2.719420   -3.904125
 6             2.529968    0.352422   -0.846706
 1             2.907592    1.096072    0.134562
 6             4.095598    1.300263    0.449694
 1             4.096612    0.759856    1.395150
 1             4.856777    0.962052   -0.242783
47             0.398282    0.779287   -0.283561
 1             4.042842    2.384149    0.533698
 6             2.930101   -1.058472   -0.688762
 6             3.566228   -1.778858   -1.715798
 6             2.630773   -1.722461    0.519366
 6             3.870562   -3.126771   -1.547058
 6             2.964154   -3.056536    0.699515
 6             3.576749   -3.763089   -0.341066
 1             3.781218   -1.297828   -2.661554
 1             2.128832   -1.181492    1.313695
 1             4.334472   -3.683895   -2.352998
 1             2.722517   -3.560926    1.628996
 6             3.941155   -5.207474   -0.126128
 9             5.064379   -5.322761    0.623390
 9             2.965483   -5.873096    0.530870
 9             4.169812   -5.856281   -1.286919
 6             3.659477    4.502654   -2.755570
 9             3.718364    5.292109   -3.846588
 9             2.809020    5.063831   -1.876759
 9             4.881899    4.482234   -2.185214

-Ag 0
LANL2DZ
F 1 1.000
1.611 1.000
****
-Br 0
LANL2DZ
P 1 1.000
0.03760 1.000
D 1 1.000
0.43400 1.000
****
-C N H B O F 0
6-31G(d,p)
****

Ag Br 0
LANL2DZ









