%chk=000206631.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206631

0 1
O 6.389132 -0.227478 0.491409
O 0.238180 0.448946 -2.848301
N 3.670328 -0.143057 -0.383937
C -0.144205 0.399206 -0.447659
C 1.219408 -0.333642 -0.372559
C -0.095629 1.631804 0.490786
C 2.409759 0.520723 -0.849742
C -1.322976 -0.522584 -0.117585
C -0.170817 1.254065 1.975653
C 4.796569 0.102573 -1.343717
C 4.057613 0.332294 0.985226
C -0.380487 0.873232 -1.901775
C -2.691253 -0.048015 -0.111342
C -1.087933 -1.851807 0.165025
C 6.038759 -0.651439 -0.842638
C 5.313532 -0.433333 1.430372
C -3.739440 -0.968789 0.169265
C -0.010157 2.476970 2.874706
C -2.140207 -2.763295 0.458788
C -3.073202 1.307472 -0.374463
C -3.440332 -2.337348 0.459079
C -5.104447 -0.533893 0.162768
C -4.385955 1.706775 -0.376229
C -5.424109 0.771393 -0.107348
H 1.189228 -1.250119 -1.000593
H 1.394721 -0.675643 0.667321
H -0.918327 2.338812 0.252360
H 0.843930 2.193968 0.297854
H 2.311044 1.570436 -0.492582
H 2.392355 0.563253 -1.963919
H -1.139715 0.756464 2.187730
H 0.609727 0.504414 2.214965
H 4.496813 -0.289787 -2.339730
H 5.035018 1.180278 -1.468288
H 4.251807 1.425765 1.025665
H 3.217561 0.121160 1.680272
H -1.169099 1.635285 -2.025667
H -0.076698 -2.265117 0.166184
H 5.879389 -1.744254 -0.840428
H 6.944536 -0.394629 -1.418377
H 5.737343 -0.034903 2.368041
H 5.121057 -1.516731 1.523124
H -0.794433 3.220609 2.692148
H 0.955156 2.972251 2.722583
H -0.070227 2.197055 3.933212
H -1.885721 -3.800229 0.676042
H -2.292713 2.052039 -0.562887
H -4.259078 -3.021925 0.674626
H -5.882944 -1.265899 0.376282
H -4.653094 2.742654 -0.580278
H -6.458665 1.109623 -0.118042


%chk=000206631-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206631

0 1
O 6.483515 -0.503064 0.261991
O -0.412020 0.225493 -2.768762
N 3.686903 -0.115072 -0.443770
C -0.195225 0.484216 -0.306887
C 1.198163 -0.245343 -0.240990
C -0.228059 1.723043 0.656295
C 2.413513 0.624394 -0.636972
C -1.363138 -0.483325 0.022479
C 0.169570 1.436071 2.121740
C 4.783523 0.397574 -1.307771
C 4.130934 -0.144213 0.974362
C -0.289248 0.974127 -1.774514
C -2.744165 -0.092469 -0.212886
C -1.118075 -1.736855 0.598934
C 6.035211 -0.478907 -1.141021
C 5.395661 -1.007636 1.115212
C -3.813930 -0.993858 0.181832
C -0.073085 2.660220 3.031121
C -2.171884 -2.622643 0.979377
C -3.129717 1.146337 -0.833221
C -3.499518 -2.256426 0.781557
C -5.181521 -0.622063 -0.042014
C -4.468231 1.481833 -1.045118
C -5.511270 0.592871 -0.641405
H 1.172032 -1.117078 -0.919070
H 1.350422 -0.626339 0.784196
H -1.248105 2.150637 0.658219
H 0.437702 2.514777 0.252897
H 2.419732 1.586949 -0.066073
H 2.342933 0.885750 -1.709913
H -0.412271 0.572528 2.498655
H 1.238415 1.150003 2.177751
H 4.452108 0.365232 -2.362856
H 5.046466 1.456947 -1.058038
H 4.347993 0.888951 1.350429
H 3.331583 -0.573849 1.606460
H -0.161470 2.083494 -1.909943
H -0.091945 -2.070620 0.768567
H 5.810540 -1.513068 -1.480019
H 6.884958 -0.074903 -1.715632
H 5.788438 -0.972310 2.144943
H 5.159053 -2.058078 0.839905
H -1.142995 2.940772 3.039315
H 0.501692 3.538719 2.680898
H 0.229756 2.453000 4.073605
H -1.922545 -3.590794 1.426910
H -2.364987 1.851759 -1.173202
H -4.317854 -2.926213 1.070916
H -5.968591 -1.321441 0.264697
H -4.721292 2.431294 -1.529295
H -6.558574 0.865176 -0.810488


