%chk=000199083.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199083

0 1
O 4.483504 0.252058 -0.767026
O 2.208558 1.899838 -1.519383
O 4.019017 -1.903908 0.849003
O -1.226120 -1.166148 1.914363
N -1.710633 -1.258930 -0.315353
N -5.468071 2.100074 0.048323
C 0.558783 -0.675963 0.367128
C -3.143508 -1.545282 -0.081240
C 1.594985 -1.503279 0.817414
C 0.803868 0.451216 -0.405883
C 3.206481 -0.037947 -0.316797
C 2.138535 0.775772 -0.745814
C 2.912352 -1.184042 0.471434
C -0.850260 -1.030081 0.762195
C -3.957566 -0.271331 -0.046909
C -4.836192 0.050633 -1.088206
C -3.839708 0.602998 1.042556
C -5.572859 1.244134 -1.000089
C -4.609292 1.775162 1.051847
C 5.475494 0.419271 0.284169
C 3.513861 2.375320 -1.944697
C 3.811942 -3.065352 1.694909
H -3.502567 -2.242710 -0.870890
H -3.253405 -2.086029 0.895944
H 1.361621 -2.366665 1.435452
H 0.006917 1.112777 -0.741585
H -1.440666 -1.031241 -1.267383
H -4.954097 -0.601648 -1.948485
H -3.158032 0.370374 1.865376
H -6.273952 1.536126 -1.790606
H -4.549508 2.488351 1.882672
H 5.637533 -0.537929 0.795608
H 5.163099 1.196655 0.983703
H 6.360520 0.715980 -0.288081
H 4.039345 1.590613 -2.502343
H 4.095184 2.690760 -1.074351
H 3.240935 3.221706 -2.585292
H 3.209230 -3.812737 1.170551
H 3.360608 -2.768838 2.646416
H 4.841166 -3.419858 1.836249


%chk=000199083-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000199083

0 1
O 4.674385 0.114044 -0.730532
O 2.420284 1.597466 -1.862141
O 4.136992 -1.951701 1.063772
O -1.010599 -2.136711 1.445995
N -1.759859 -0.930169 -0.393872
N -5.880088 2.130321 0.186884
C 0.644734 -0.919075 0.146344
C -3.165160 -1.298578 -0.186827
C 1.697006 -1.623701 0.780768
C 0.941835 0.156823 -0.715101
C 3.354522 -0.184474 -0.353984
C 2.285065 0.534126 -0.963392
C 3.034244 -1.270115 0.525022
C -0.755595 -1.373350 0.458256
C -4.094265 -0.096411 -0.074588
C -5.374658 -0.105204 -0.679382
C -3.727324 1.057290 0.662946
C -6.223824 1.014303 -0.522450
C -4.640049 2.129919 0.765648
C 5.635993 0.446380 0.345112
C 3.606146 2.473148 -1.834292
C 3.860429 -3.133069 1.889959
H -3.514347 -1.966776 -0.998575
H -3.178595 -1.888761 0.750454
H 1.423393 -2.439578 1.454486
H 0.171468 0.777480 -1.183956
H -1.516458 -0.390630 -1.224976
H -5.711285 -0.967527 -1.266643
H -2.747849 1.116619 1.148928
H -7.218541 1.030770 -0.982572
H -4.381586 3.031495 1.332807
H 5.748683 -0.401229 1.038970
H 5.301295 1.348862 0.893921
H 6.583856 0.651654 -0.175217
H 4.489181 1.958682 -2.242470
H 3.819932 2.818958 -0.804703
H 3.323717 3.331537 -2.463803
H 3.299907 -3.894860 1.316334
H 3.294117 -2.862711 2.801259
H 4.850001 -3.525344 2.166509


