%chk=000225055.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225055

0 1
O -2.198105 -0.972591 0.603149
O -0.173473 -1.472872 -1.855886
O 2.396106 1.879710 0.406430
O -2.402674 0.749171 -0.861933
O 3.605767 -2.511857 0.467114
N 1.665972 -1.977174 -0.662056
N 2.956174 -0.298973 0.461305
C 0.726864 0.377671 -0.542915
C -0.383601 0.505199 0.543132
C 0.510799 1.348199 -1.731077
C -0.506466 1.914760 1.158615
C 0.668717 -1.057220 -1.096314
C 2.060284 0.752875 0.121832
C -1.756910 0.158403 -0.032578
C 1.551156 1.182639 -2.829516
C -1.333938 1.892293 2.438604
C 2.807082 -1.670729 0.122863
C -3.504283 -1.518759 0.219857
C -4.610203 -0.690156 0.836590
H -0.148493 -0.226945 1.364305
H 0.523841 2.392240 -1.350752
H -0.513428 1.189447 -2.145544
H 0.498906 2.338061 1.372837
H -0.964346 2.609018 0.421368
H 2.572737 1.356619 -2.471766
H 1.513789 0.189222 -3.294288
H 1.373588 1.908184 -3.636599
H -2.346627 1.504073 2.270122
H -1.441685 2.904360 2.850131
H -0.871764 1.274592 3.217907
H 1.573232 -2.958610 -0.976329
H 3.820181 -0.041904 0.969059
H -3.555052 -1.550242 -0.883585
H -3.430189 -2.537961 0.641142
H -5.591742 -1.154559 0.681522
H -4.468108 -0.562764 1.917042
H -4.649606 0.315481 0.390214


%chk=000225055-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225055

0 1
O -2.024091 -1.039193 0.466413
O -0.275418 -1.279803 -2.040611
O 2.673872 1.774052 0.194560
O -2.527564 0.977664 -0.595908
O 2.932552 -2.797676 0.954365
N 1.265033 -1.996191 -0.477416
N 2.701153 -0.491827 0.636141
C 0.743784 0.458523 -0.615458
C -0.347751 0.682045 0.556404
C 0.564562 1.475508 -1.776217
C -0.398769 2.140171 1.080091
C 0.538278 -0.982105 -1.131180
C 2.112713 0.656156 0.066916
C -1.740101 0.262356 0.062489
C 1.562706 1.278708 -2.936939
C -1.187025 2.241009 2.404601
C 2.333183 -1.833038 0.419642
C -3.322354 -1.620657 -0.011133
C -4.460187 -1.268107 0.949842
H -0.082854 -0.003661 1.384256
H 0.692677 2.487825 -1.357786
H -0.470277 1.390043 -2.148935
H 0.627429 2.520977 1.225389
H -0.882993 2.774771 0.316573
H 2.608948 1.388242 -2.597632
H 1.441199 0.291230 -3.416070
H 1.387490 2.044761 -3.713015
H -2.234016 1.909016 2.279474
H -1.210391 3.286835 2.759060
H -0.724687 1.625680 3.199160
H 1.030382 -2.964318 -0.719308
H 3.546667 -0.349987 1.198749
H -3.513854 -1.240782 -1.029226
H -3.121766 -2.703239 -0.040706
H -5.387541 -1.776103 0.626064
H -4.227978 -1.598410 1.977044
H -4.648509 -0.181573 0.954310


