%chk=000278035.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278035

0 1
O 4.362467 -0.935399 1.757228
O 5.489093 0.876002 0.717044
O -0.245454 -2.495806 0.301615
O -0.563137 1.074836 -2.531939
N -0.348318 -0.714218 -1.124124
C 0.893749 -1.175298 -1.826580
C -3.061475 -0.279135 0.354449
C -2.340568 0.992527 0.568760
C -2.392929 -1.476518 0.062329
C -1.317851 1.422206 -0.288672
C 2.123080 -0.584653 -1.179135
C -0.921377 -1.599018 -0.161748
C -0.777285 0.624449 -1.428044
C 2.576343 -1.147531 0.043589
C 3.706758 -0.582844 0.583259
C 2.781096 0.486514 -1.783026
C -4.465314 -0.291270 0.471619
C -2.707988 1.808758 1.656170
C -3.117366 -2.677483 -0.055999
C -0.705337 2.672843 -0.087109
C 4.385120 0.507646 -0.041693
C 3.945003 1.062368 -1.221645
C -5.180178 -1.479149 0.326659
C -2.081948 3.036858 1.865285
C -4.504649 -2.679644 0.073811
C -1.085031 3.477107 0.985831
C 5.506592 -0.028542 1.870690
H 0.813255 -0.881724 -2.901463
H 0.936160 -2.290642 -1.795180
H 2.037600 -1.971227 0.518710
H 2.395151 0.905447 -2.714446
H -4.998291 0.640153 0.666621
H -3.480407 1.470795 2.348019
H -2.580373 -3.611131 -0.246885
H 0.071817 3.008854 -0.779494
H 4.455599 1.892585 -1.699659
H -6.267309 -1.474604 0.413179
H -2.370088 3.656974 2.714899
H -5.061411 -3.611316 -0.022439
H -0.605292 4.443061 1.141263
H 6.422388 -0.631079 1.811970
H 5.368404 0.577649 2.775282


%chk=000278035-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278035

0 1
O 4.613876 -1.266351 1.658740
O 5.803537 0.592698 0.705156
O -0.275662 -2.569639 0.101120
O -0.205160 1.380008 -2.325046
N -0.308770 -0.570299 -1.073659
C 0.928950 -1.031553 -1.811162
C -3.138884 -0.259684 0.362151
C -2.518973 1.081118 0.528593
C -2.396930 -1.441511 0.066787
C -1.437713 1.556025 -0.270972
C 2.222431 -0.555913 -1.164792
C -0.925671 -1.530860 -0.227191
C -0.687399 0.783166 -1.317405
C 2.724150 -1.232256 -0.010553
C 3.921288 -0.762829 0.526668
C 2.929128 0.540140 -1.720582
C -4.543848 -0.387658 0.564872
C -3.065777 1.965456 1.503257
C -3.057047 -2.702205 0.045882
C -0.981215 2.895153 -0.118227
C 4.622245 0.328220 -0.032494
C 4.150973 1.004368 -1.159428
C -5.194285 -1.633130 0.503665
C -2.584052 3.276105 1.672167
C -4.443153 -2.805802 0.255646
C -1.539945 3.752570 0.845342
C 5.836427 -0.431848 1.785029
H 0.837881 -0.634071 -2.833796
H 0.879375 -2.131091 -1.826200
H 2.177396 -2.073688 0.423807
H 2.514387 1.047148 -2.597657
H -5.135754 0.515331 0.744707
H -3.863411 1.601511 2.158530
H -2.449239 -3.593217 -0.136185
H -0.177068 3.238444 -0.775322
H 4.698152 1.847418 -1.588267
H -6.278575 -1.689481 0.647475
H -3.017653 3.920661 2.444246
H -4.932536 -3.784414 0.218825
H -1.161557 4.773733 0.957420
H 6.725658 -1.071227 1.644597
H 5.824721 0.078854 2.763257


