%chk=000278304.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278304

0 1
O -3.103215 -0.221592 -0.637941
O 4.376301 -2.177947 0.724616
O 7.015587 1.828635 -0.316172
N -6.537562 -0.222369 0.592989
C -7.863896 -0.500323 -0.053318
C -6.725808 1.073455 1.329007
C -8.591766 0.846226 -0.260681
C -7.861898 1.860722 0.638644
C -5.424765 -0.152328 -0.403961
C -4.142647 -0.568209 0.331719
C -1.797327 -0.499972 -0.318135
C 2.355705 -1.166911 0.245218
C 0.928034 -0.938080 0.054133
C 3.415912 -0.193684 0.022808
C -1.359849 -1.088265 0.875056
C -0.892708 -0.125008 -1.336000
C 4.631192 -0.865963 0.330287
C 0.010397 -1.303452 1.049600
C 0.462892 -0.347131 -1.139931
C 2.967077 -2.319651 0.658468
C 3.469280 1.150212 -0.377707
C 5.897075 -0.284599 0.249685
C 5.895284 1.050341 -0.161806
C 4.704884 1.769891 -0.472158
C 8.304404 1.228913 -0.032937
H -8.426392 -1.146629 0.655093
H -7.760015 -1.070010 -0.993625
H -5.790911 1.658476 1.389478
H -7.009338 0.805342 2.369440
H -9.658194 0.765684 0.004100
H -8.556045 1.158220 -1.317460
H -7.460406 2.698084 0.044471
H -8.543604 2.305354 1.381300
H -5.287583 0.848950 -0.867681
H -5.610318 -0.853047 -1.246564
H -4.104118 -1.650624 0.534337
H -3.969591 0.005532 1.256636
H -2.054371 -1.375674 1.657033
H -1.273888 0.325412 -2.249334
H 0.367105 -1.754889 1.975952
H 1.178457 -0.072363 -1.916467
H 2.650262 -3.299181 0.935007
H 2.549984 1.690407 -0.604169
H 6.789837 -0.843484 0.492962
H 4.797180 2.809616 -0.779149
H 8.489667 0.391084 -0.711394
H 8.358214 0.924863 1.016463
H 8.988786 2.062366 -0.238312


%chk=000278304-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278304

0 1
O -3.169422 -0.049340 -0.747686
O 4.340785 -1.985680 1.082256
O 7.329900 1.639983 -0.535109
N -6.656399 -0.365598 0.536299
C -7.981824 -0.616767 -0.098992
C -6.936761 0.751468 1.490584
C -8.617129 0.790255 -0.338147
C -8.045932 1.655734 0.831639
C -5.560258 -0.065200 -0.423395
C -4.218417 -0.470778 0.198903
C -1.835529 -0.312183 -0.406117
C 2.377831 -0.968707 0.354985
C 0.942748 -0.734760 0.100111
C 3.512128 -0.109081 -0.001386
C -1.422241 -0.959404 0.785770
C -0.864819 0.120305 -1.344197
C 4.684104 -0.769019 0.458634
C -0.046210 -1.157718 1.026748
C 0.501025 -0.089675 -1.091614
C 2.926177 -2.066619 0.997995
C 3.668226 1.160784 -0.620650
C 5.991443 -0.274183 0.329911
C 6.109375 0.984109 -0.307834
C 4.958578 1.693451 -0.769901
C 8.549468 0.969546 -0.080845
H -8.605201 -1.193731 0.611892
H -7.869213 -1.218777 -1.016268
H -6.010897 1.308663 1.715866
H -7.311579 0.323950 2.439261
H -9.720631 0.755930 -0.340870
H -8.291112 1.192348 -1.314676
H -7.626124 2.605624 0.457575
H -8.828124 1.909233 1.568828
H -5.508216 1.006656 -0.724077
H -5.716438 -0.655068 -1.344141
H -4.186103 -1.566585 0.354004
H -4.067820 0.032268 1.176377
H -2.151695 -1.297165 1.527690
H -1.204240 0.609170 -2.262519
H 0.266820 -1.629012 1.965642
H 1.235312 0.217010 -1.843979
H 2.494192 -2.977302 1.403680
H 2.800817 1.732423 -0.963672
H 6.846398 -0.838140 0.708679
H 5.118149 2.667927 -1.240597
H 8.683947 -0.006624 -0.586928
H 8.541448 0.819766 1.016682
H 9.370764 1.646913 -0.356814


