%chk=000249766.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249766

0 1
O 3.831580 0.452976 0.533564
O -1.348827 -1.610481 -0.205554
N 1.573191 -0.088978 -1.093793
N -0.704050 -0.169296 -1.913999
N -2.660130 0.254381 -0.606843
C 2.921774 0.097445 -1.711419
C 1.702022 -0.728197 0.253108
C 3.729547 1.039236 -0.788255
C 2.570082 0.159620 1.169894
C 0.626337 -0.841011 -1.977646
C -3.726601 -0.089107 0.399429
C 5.177938 1.184247 -1.233421
C 1.863841 1.440014 1.602150
C -3.093703 -0.200987 1.810102
C -4.782566 1.028545 0.337817
C -4.366441 -1.435591 0.017837
C -1.558104 -0.578116 -0.833613
C -2.438421 1.080734 2.310720
H 2.802996 0.564081 -2.710508
H 3.470917 -0.857372 -1.853161
H 2.144587 -1.746528 0.201807
H 0.680302 -0.849432 0.684899
H 3.222370 2.023793 -0.689628
H 2.922614 -0.421901 2.055214
H 0.501215 -1.915529 -1.691127
H 0.952602 -0.803303 -3.043630
H 5.257242 1.621924 -2.232189
H 5.731605 1.824094 -0.532453
H 5.694896 0.215635 -1.235606
H 1.080014 1.235351 2.338166
H 2.577419 2.142270 2.049061
H 1.388903 1.944856 0.751020
H -2.336837 -1.019047 1.791064
H -3.871354 -0.530009 2.524785
H -0.631358 0.840491 -2.075728
H -2.860074 1.022142 -1.239816
H -4.349775 2.016612 0.531041
H -5.292356 1.063715 -0.630547
H -5.554165 0.865560 1.099999
H -4.791001 -1.417171 -0.990304
H -3.615639 -2.243191 0.033396
H -5.164181 -1.715301 0.710694
H -1.666405 1.433649 1.615653
H -3.164470 1.890161 2.440584
H -1.953632 0.915716 3.280137


%chk=000249766-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249766

0 1
O 4.123993 0.587505 0.499266
O -1.507770 -1.747345 -0.320435
N 1.723274 0.197107 -1.037920
N -0.673562 0.144269 -1.430396
N -2.784246 0.225593 -0.405604
C 3.053740 -0.048649 -1.647367
C 1.753769 -0.125492 0.411684
C 4.112790 0.839287 -0.961157
C 2.790095 0.762725 1.131784
C 0.609910 -0.467425 -1.757963
C -3.965143 -0.259530 0.372691
C 5.535477 0.556038 -1.444736
C 2.376771 2.245186 1.206617
C -3.536512 -0.706538 1.808115
C -4.958328 0.926952 0.430762
C -4.626567 -1.458277 -0.359511
C -1.656242 -0.537427 -0.689392
C -2.815931 0.367581 2.648195
H 3.008816 0.200946 -2.725240
H 3.368903 -1.118660 -1.550133
H 2.017494 -1.198425 0.577062
H 0.749528 0.044483 0.839333
H 3.846360 1.902433 -1.144523
H 2.949201 0.371021 2.153190
H 0.505711 -1.547465 -1.513142
H 0.818849 -0.368055 -2.840988
H 5.629602 0.752174 -2.528648
H 6.252234 1.200466 -0.907983
H 5.807341 -0.496347 -1.248601
H 1.516271 2.363937 1.891596
H 3.213637 2.850838 1.595699
H 2.080606 2.628082 0.215176
H -2.879701 -1.587813 1.697453
H -4.451802 -1.043005 2.334942
H -0.748618 1.151517 -1.584944
H -2.848664 1.168375 -0.793587
H -4.505984 1.818936 0.901850
H -5.303085 1.201846 -0.584226
H -5.846234 0.644599 1.022275
H -4.962852 -1.161221 -1.369718
H -3.904047 -2.285114 -0.456687
H -5.504278 -1.815163 0.210285
H -1.917534 0.740230 2.122328
H -3.466260 1.233573 2.871303
H -2.487108 -0.057047 3.614198


