%chk=000268228.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268228

0 1
O -3.736752 1.881032 0.386746
O -3.344181 -2.529835 -0.592388
O 4.884540 0.062789 0.519536
N -3.505118 -0.330981 -0.033103
N -0.698410 3.461369 -0.530099
N -0.649697 -1.939668 2.390665
C -0.696614 -0.022744 -0.564518
C -1.443858 1.085176 0.255656
C -1.249690 -1.412964 -0.094563
C 0.802091 0.000697 -0.304501
C -1.008076 0.163622 -2.054681
C -2.969257 0.967905 0.206738
C -2.767042 -1.519607 -0.273495
C 1.330786 0.497780 0.905764
C 1.688618 -0.512069 -1.261698
C -1.037029 2.413581 -0.184936
C -0.918665 -1.704982 1.292857
C 2.695612 0.504173 1.146666
C 3.069274 -0.521212 -1.048264
C 3.564589 -0.006431 0.156169
C 5.876921 -0.426833 -0.417118
H -1.158488 0.977870 1.351374
H -0.777489 -2.212927 -0.743364
H -0.660583 -0.679040 -2.665660
H -2.077738 0.284189 -2.262690
H -0.511435 1.063639 -2.451566
H -4.537380 -0.402912 -0.075139
H 0.662396 0.883794 1.680364
H 1.310191 -0.918858 -2.201857
H 3.111897 0.889067 2.076951
H 3.731407 -0.920849 -1.809559
H 5.734694 -1.496006 -0.597320
H 6.810000 -0.241810 0.132992
H 5.846487 0.155644 -1.342260


%chk=000268228-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268228

0 1
O -3.885683 1.734928 0.541382
O -3.257204 -2.628973 -0.870386
O 4.997272 0.143116 0.446688
N -3.507162 -0.461666 -0.071011
N -0.955876 3.585611 -0.155357
N -0.658935 -2.050518 2.324290
C -0.709837 0.047730 -0.569530
C -1.523442 1.031271 0.352030
C -1.216040 -1.408926 -0.206793
C 0.812011 0.107866 -0.306294
C -1.026006 0.346853 -2.061610
C -3.060753 0.830509 0.282188
C -2.734478 -1.581006 -0.427265
C 1.397119 0.852642 0.752753
C 1.682079 -0.652459 -1.128182
C -1.215183 2.446594 0.078480
C -0.898189 -1.769304 1.190018
C 2.784540 0.845356 0.973971
C 3.076690 -0.675894 -0.921127
C 3.635313 0.081109 0.139331
C 5.921717 -0.635165 -0.384691
H -1.251925 0.822019 1.410101
H -0.721610 -2.138443 -0.872555
H -0.544564 -0.388707 -2.726827
H -2.110058 0.329505 -2.274663
H -0.640078 1.344614 -2.329283
H -4.528056 -0.572352 -0.132550
H 0.786125 1.464880 1.422521
H 1.280590 -1.246551 -1.958106
H 3.229847 1.425206 1.787383
H 3.707063 -1.278800 -1.581079
H 5.697554 -1.717846 -0.328120
H 6.917867 -0.440204 0.037561
H 5.891295 -0.300395 -1.439569


