%chk=000179996.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179996

0 1
O -3.578892 1.649027 -0.602049
O 1.181354 -2.515937 -0.069912
N -0.984377 -0.305726 0.298774
N -0.418821 1.921410 0.254490
N 2.039258 1.538234 -0.073151
N 2.720437 -0.801703 -0.208562
N 4.350719 0.918462 -0.201177
C -2.056277 -1.337017 0.407370
C -3.339038 -0.452086 0.491332
C -2.930563 1.050084 0.521306
C -1.433805 1.016567 0.365373
C 0.387882 -0.273715 0.119406
C -2.020210 -2.290582 -0.772682
C 0.711407 1.118269 0.099558
C 1.403904 -1.327312 -0.045265
C 3.002976 0.494760 -0.179183
H -1.903763 -1.904468 1.363892
H -3.941740 -0.716073 1.374113
H -3.993755 -0.615882 -0.391781
H -3.257448 1.584405 1.438951
H -1.043944 -2.812540 -0.825126
H -2.794478 -3.062228 -0.690741
H -2.158276 -1.780497 -1.735100
H -3.121747 2.480870 -0.865613
H 2.276930 2.521769 0.031075
H 4.573165 1.730911 -0.762357
H 5.024903 0.161098 -0.330941


%chk=000179996-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179996

0 1
O -3.506263 1.325801 -0.894324
O 1.203469 -2.583798 0.069690
N -0.957952 -0.333362 0.327478
N -0.411656 1.886446 0.229578
N 2.034883 1.499493 -0.052621
N 2.763588 -0.814670 -0.112015
N 4.319115 0.916086 -0.298247
C -2.028356 -1.362070 0.387930
C -3.270302 -0.469771 0.759208
C -2.911702 1.009683 0.427919
C -1.411599 0.968741 0.365409
C 0.423747 -0.298480 0.147224
C -2.149898 -2.125150 -0.943930
C 0.713612 1.083790 0.099316
C 1.448532 -1.337505 0.038691
C 3.011039 0.494696 -0.149979
H -1.787391 -2.073098 1.197355
H -3.499052 -0.566618 1.834135
H -4.161437 -0.763770 0.182553
H -3.291875 1.721772 1.183613
H -1.203333 -2.646294 -1.168298
H -2.951674 -2.881150 -0.866899
H -2.399782 -1.433182 -1.767014
H -3.148563 2.200066 -1.197971
H 2.250355 2.496925 -0.087602
H 4.597912 1.892607 -0.329668
H 5.020385 0.182910 -0.369534


