%chk=TS12_1Ph_proAz-TS-F.chk
%nproc=24
%mem=120GB
#p freq=NoRaman B3LYP gen pseudo=read empiricaldispersion=GD3 nosymm scf=xqc SCRF=(SMD,solvent=dichloromethane)

Copper nitrenes - Enynes    --  PROJECT

0 3
29      -1.343738000     -0.312096000     -0.693524000
7        0.701742000     -0.988582000     -1.353153000
7        1.746960000     -0.472055000     -0.650199000
7       -0.486977000      1.621591000     -0.591250000
7        0.718922000      1.726692000      0.043027000
7       -0.749874000     -0.424935000      1.374807000
7        0.584286000     -0.258423000      1.597667000
5        1.474532000      0.465023000      0.547409000
6        1.217074000     -1.755481000     -2.306658000
6        2.625175000     -1.757172000     -2.245528000
6        2.915758000     -0.917443000     -1.173195000
6       -0.887484000      2.858857000     -0.877299000
6        0.060213000      3.803911000     -0.441452000
6        1.063820000      3.032996000      0.139279000
6       -1.270593000     -0.958871000      2.476056000
6       -0.269804000     -1.180374000      3.441556000
6        0.894915000     -0.716894000      2.833381000
1        2.496448000      0.784723000      1.048556000
7       -2.649851000     -1.792745000     -0.661899000
16      -3.286537000     -1.451605000     -2.136007000
8       -3.292731000     -2.519393000     -3.149659000
8       -2.532398000     -0.173147000     -2.493256000
6       -4.964952000     -0.992366000     -1.771634000
6       -5.992422000     -1.904796000     -2.020158000
6       -5.210619000      0.229386000     -1.135443000
6       -7.290318000     -1.571142000     -1.640409000
1       -5.775127000     -2.856458000     -2.491497000
6       -6.514302000      0.543814000     -0.765240000
1       -4.393680000      0.914297000     -0.937353000
6       -7.572658000     -0.348058000     -1.011739000
1       -8.096302000     -2.274970000     -1.828256000
1       -6.716226000      1.491751000     -0.273924000
6       -8.985161000      0.012896000     -0.630963000
1       -9.484805000      0.530389000     -1.459925000
1       -9.576696000     -0.877511000     -0.398120000
1       -9.007943000      0.683044000      0.233500000
6       -1.383893000     -3.969939000      0.636843000
6       -2.162684000     -4.003750000     -0.509026000
1       -1.656482000     -3.958681000     -1.467889000
6       -0.008442000     -3.703639000      0.638243000
6        1.190087000     -3.497393000      0.683358000
35      -3.123828000     -1.242442000      2.647761000
35      -2.532862000      3.205648000     -1.727937000
35       0.103270000     -2.674303000     -3.511701000
35       3.835849000     -2.682360000     -3.352376000
35       4.612412000     -0.418221000     -0.522624000
35       2.639769000     -0.707817000      3.537534000
35      -0.457230000     -1.932965000      5.156949000
35      -0.010278000      5.678041000     -0.604388000
35       2.657071000      3.640968000      0.935816000
1       -1.844786000     -4.157048000      1.603991000
6       -3.548091000     -4.491210000     -0.524310000
6       -4.411562000     -4.332601000      0.575042000
6       -4.035276000     -5.120620000     -1.682960000
6       -5.722201000     -4.799008000      0.518455000
6       -5.344181000     -5.599287000     -1.733586000
6       -6.192690000     -5.436849000     -0.634843000
1       -4.060456000     -3.819445000      1.463333000
1       -3.383879000     -5.224323000     -2.544512000
1       -6.381072000     -4.659054000      1.370592000
1       -5.704003000     -6.090261000     -2.633163000
1       -7.216022000     -5.798564000     -0.677930000
1        2.244673000     -3.332240000      0.696040000

-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 0
6-31G(d,p)
****

Cu Br 0
LANL2DZ









