%chk=000213069.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213069

0 1
O 0.076910 0.891147 -0.385659
O -2.859189 2.615716 0.141172
O 1.064123 -0.881345 -1.459794
O -4.982202 2.550762 1.026832
N 2.129765 0.314254 0.275303
N -4.388701 4.081955 -0.625758
C -2.278479 0.256421 -0.182289
C -1.870240 -1.007152 0.610231
C -3.553146 0.036849 -1.032889
C -1.155390 0.696110 -1.152531
C -2.490270 1.390017 0.850905
C -1.635698 -2.246082 -0.262291
C -4.770967 -0.404700 -0.229187
C -1.295801 -3.472597 0.597134
C -1.043374 -4.706986 -0.265805
C 1.104274 -0.010433 -0.618401
C -4.169850 3.039393 0.269585
C 3.398487 -0.347840 0.337884
C 4.330073 0.138318 1.278137
C 3.714374 -1.439139 -0.488482
C 5.576240 -0.481341 1.380024
C 4.967684 -2.040899 -0.367144
C 5.900360 -1.568783 0.562217
H -0.949799 -0.789190 1.188786
H -2.655026 -1.233228 1.360182
H -3.341933 -0.718300 -1.817253
H -3.794415 0.976856 -1.571218
H -1.337039 1.708893 -1.560094
H -0.984747 -0.029724 -1.967471
H -1.542233 1.684772 1.338458
H -3.260107 1.142324 1.603504
H -0.809298 -2.058769 -0.981488
H -2.531002 -2.458303 -0.877402
H -5.630541 -0.579174 -0.886916
H -4.587365 -1.333697 0.321684
H -5.081104 0.360422 0.500122
H -0.400626 -3.262782 1.215178
H -2.117845 -3.676462 1.310233
H -1.923461 -4.970920 -0.862540
H -0.789594 -5.576452 0.350216
H -0.212251 -4.544840 -0.963193
H 1.976535 1.107896 0.904730
H -3.607571 4.511151 -1.099220
H -5.205297 4.662269 -0.491802
H 4.091253 0.982695 1.918916
H 2.990275 -1.814689 -1.218715
H 6.301615 -0.111488 2.104720
H 5.217916 -2.888283 -1.006331
H 6.873973 -2.045124 0.648521


%chk=000213069-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213069

0 1
O 0.098897 0.815788 -0.383313
O -2.786084 2.618043 0.184326
O 1.150505 -1.014941 -1.449738
O -4.969083 2.708128 1.097281
N 2.226977 0.334444 0.175967
N -4.102020 4.411209 -0.262950
C -2.324555 0.188241 -0.216411
C -1.998029 -1.114962 0.578182
C -3.581030 0.034720 -1.132904
C -1.153900 0.584187 -1.153213
C -2.535266 1.305472 0.837299
C -1.837218 -2.407215 -0.256244
C -4.874125 -0.435607 -0.430060
C -1.466064 -3.620460 0.628446
C -1.318831 -4.926747 -0.180731
C 1.174401 -0.060615 -0.632245
C -4.047219 3.205700 0.402811
C 3.520295 -0.249487 0.277760
C 4.433538 0.347346 1.188354
C 3.918194 -1.382795 -0.479795
C 5.730617 -0.182345 1.341645
C 5.221055 -1.900117 -0.313114
C 6.134263 -1.311603 0.591441
H -1.065956 -0.948729 1.157214
H -2.796695 -1.277370 1.330836
H -3.335317 -0.674963 -1.947858
H -3.773653 1.009856 -1.624039
H -1.371714 1.547134 -1.644535
H -0.959233 -0.195144 -1.910206
H -1.615559 1.446803 1.429486
H -3.385648 1.076344 1.502556
H -1.047805 -2.273210 -1.020925
H -2.779216 -2.632661 -0.795356
H -5.691459 -0.525113 -1.169338
H -4.747122 -1.426469 0.042329
H -5.205739 0.281996 0.340650
H -0.515509 -3.404743 1.157813
H -2.238390 -3.753676 1.414339
H -2.263535 -5.182668 -0.697247
H -1.048317 -5.778407 0.470428
H -0.531682 -4.825345 -0.951122
H 2.034343 1.152509 0.758221
H -3.298726 4.747265 -0.788325
H -4.951121 4.964937 -0.197836
H 4.127692 1.223984 1.774058
H 3.215723 -1.838366 -1.180536
H 6.424492 0.287790 2.047257
H 5.522363 -2.774927 -0.900372
H 7.141762 -1.723714 0.710519


