%chk=000280104.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280104

0 1
O 1.084027 3.018097 1.238467
O -1.360237 2.991313 -0.656617
O 2.622930 2.531458 -0.336139
O -2.321203 2.318914 1.280002
N 0.098748 -1.156278 -0.037608
C 1.259089 -0.332286 -0.033327
C -1.058083 -0.357478 0.098493
C 0.810183 0.990328 0.141388
C 2.552596 -0.971947 -0.181284
C -0.620958 0.963253 0.217809
C 2.605867 -2.389499 -0.247448
C 0.168464 -2.565023 -0.104135
C -2.419515 -0.893673 0.094981
C 1.380400 -3.164646 -0.197720
C 3.758273 -0.238984 -0.274661
C 1.618373 2.203608 0.259218
C 3.855898 -3.040832 -0.370999
C -1.517052 2.120221 0.398298
C -2.864059 -1.711818 -0.957590
C -3.293137 -0.562294 1.143653
C 4.973128 -0.893763 -0.397948
C 5.025090 -2.301556 -0.440286
C -4.167394 -2.212679 -0.944553
C -4.595519 -1.068053 1.147828
C -5.032101 -1.896437 0.109367
C 1.734619 4.301389 1.437771
C -2.162215 4.202607 -0.616652
H -0.783051 -3.104519 -0.060452
H 1.459134 -4.252014 -0.240925
H 3.734600 0.858175 -0.268947
H 3.889828 -4.128598 -0.413441
H -2.201467 -1.937834 -1.792056
H -2.957486 0.108585 1.941972
H 5.897007 -0.319268 -0.468219
H 5.989078 -2.801113 -0.533491
H -4.513620 -2.844968 -1.760785
H -5.272184 -0.809167 1.961915
H -6.047663 -2.289589 0.116440
H 2.804886 4.155236 1.615746
H 1.220000 4.690156 2.322971
H 1.570093 4.927795 0.555997
H -3.221608 3.945698 -0.515847
H -1.941177 4.663219 -1.585206
H -1.832183 4.825065 0.220322


%chk=000280104-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280104

0 1
O 0.958717 3.156822 1.168962
O -1.313373 3.044424 -0.615522
O 2.795793 2.489958 -0.082015
O -2.367613 2.328298 1.332239
N 0.116637 -1.137832 0.006208
C 1.288465 -0.326938 -0.027679
C -1.038409 -0.344786 0.199286
C 0.843743 1.013086 0.186200
C 2.572642 -0.993094 -0.206772
C -0.595165 0.980577 0.317765
C 2.599718 -2.438470 -0.264449
C 0.161574 -2.538217 -0.026360
C -2.404968 -0.908366 0.150526
C 1.363670 -3.182663 -0.150963
C 3.807684 -0.289296 -0.345807
C 1.644961 2.231921 0.364411
C 3.839531 -3.119811 -0.429674
C -1.500313 2.152555 0.442759
C -2.800904 -1.759779 -0.921749
C -3.358295 -0.588944 1.156054
C 5.015739 -0.986121 -0.507491
C 5.041080 -2.406857 -0.544657
C -4.106727 -2.289673 -0.976557
C -4.664958 -1.120211 1.095658
C -5.044062 -1.975469 0.035679
C 1.634706 4.458012 1.353805
C -2.128765 4.278648 -0.547995
H -0.795175 -3.049566 0.078190
H 1.384586 -4.276006 -0.162506
H 3.798492 0.803271 -0.346696
H 3.837583 -4.215714 -0.467995
H -2.093973 -1.978299 -1.730833
H -3.070997 0.082191 1.970148
H 5.948475 -0.421905 -0.615434
H 5.990394 -2.938315 -0.671885
H -4.396081 -2.935729 -1.812846
H -5.386419 -0.864035 1.879144
H -6.058696 -2.386898 -0.006186
H 2.632629 4.312184 1.800339
H 0.976648 5.020683 2.031339
H 1.746444 4.973610 0.384446
H -3.203219 4.029501 -0.537217
H -1.860261 4.841606 -1.452930
H -1.881138 4.846449 0.365364


