%chk=000219136.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219136

0 1
O 0.234154 -3.332373 -1.381622
N 0.982963 -2.247926 -0.940572
N 3.717256 -1.071544 1.223536
C 1.245700 -0.435348 0.636708
C -0.781347 -2.031947 0.825018
C 0.479206 -1.642706 0.095501
C 1.185563 0.727288 -0.340324
C -1.725485 -0.874945 1.002724
C 0.298749 1.784132 -0.091939
C 1.999219 0.746825 -1.481890
C -1.973540 -0.351080 2.279559
C -2.363760 -0.316883 -0.116223
C 0.237754 2.862584 -0.979107
C 1.934620 1.829082 -2.363122
C 2.629120 -0.795001 0.954724
C -2.854177 0.724134 2.433617
C -3.241148 0.757503 0.044642
C 1.056662 2.888765 -2.112319
C -3.487558 1.280801 1.318915
H 0.754882 -0.118640 1.608268
H -1.301528 -2.852585 0.271086
H -0.506522 -2.489761 1.801108
H -0.353219 1.765490 0.782083
H 2.675001 -0.085978 -1.685474
H -1.491432 -0.782134 3.154529
H -2.168153 -0.718911 -1.110107
H -0.450529 3.683667 -0.785023
H 2.570238 1.845190 -3.247428
H -3.047988 1.126407 3.427100
H -3.734659 1.188801 -0.825532
H 1.010079 3.731766 -2.799419
H -4.173478 2.116661 1.441489
H 0.782257 -3.670132 -2.169006


%chk=000219136-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219136

0 1
O -0.504942 -2.662281 -1.751493
N 0.358596 -1.536024 -1.366298
N 3.171664 -1.055070 1.751758
C 1.071870 -0.063456 0.425620
C -0.676290 -1.953427 0.908095
C 0.225905 -1.249727 -0.093759
C 1.454270 0.972089 -0.642022
C -1.863087 -1.071768 1.302797
C 0.493606 1.948349 -1.002926
C 2.716535 0.969284 -1.277504
C -2.027670 -0.618517 2.635554
C -2.816530 -0.686057 0.323642
C 0.791069 2.909582 -1.992509
C 3.015437 1.933071 -2.266926
C 2.241807 -0.603319 1.156273
C -3.127026 0.199549 2.987760
C -3.913657 0.130662 0.673889
C 2.055000 2.904849 -2.628195
C -4.072689 0.577142 2.007753
H 0.436849 0.442857 1.183065
H -1.028164 -2.896671 0.456679
H -0.080899 -2.206717 1.805481
H -0.488660 1.953942 -0.513310
H 3.466210 0.219700 -0.999844
H -1.301258 -0.914745 3.402802
H -2.696188 -1.035984 -0.708781
H 0.042692 3.662829 -2.262715
H 3.997276 1.925321 -2.753001
H -3.244347 0.538499 4.023160
H -4.646083 0.416547 -0.089580
H 2.289287 3.653318 -3.393347
H -4.925031 1.209629 2.279649
H -0.276653 -2.772253 -2.710265


