%chk=000295343.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295343

0 1
O -1.354843 1.074612 0.125280
N 5.101263 0.199828 0.365412
N -0.421046 -1.044594 -0.046661
N -2.762573 -0.759958 -0.157329
C 3.719870 -0.069098 0.181363
C 6.095805 -0.689162 -0.307694
C 5.541811 1.616057 0.489522
C 3.279534 -1.355403 -0.210897
C 2.742058 0.907254 0.494039
C 0.965140 -0.668500 0.028942
C 6.608361 -1.728849 0.690883
C 5.480686 2.409369 -0.816583
C 1.921640 -1.650798 -0.287912
C 1.385962 0.613526 0.422985
C -4.025859 -0.083039 -0.129906
C -5.210691 -0.867813 -0.083562
C -1.497141 -0.126836 -0.014853
C -4.110826 1.318252 -0.167458
C -6.447725 -0.213087 -0.083098
C -5.172573 -2.362741 -0.032961
C -5.359121 1.942348 -0.162257
C -6.529079 1.181858 -0.122044
H 6.948856 -0.088144 -0.693144
H 5.655031 -1.192761 -1.197222
H 4.914005 2.110222 1.267999
H 6.580039 1.611531 0.892170
H 3.998508 -2.136156 -0.449910
H 3.043457 1.906243 0.807254
H 7.327867 -2.407636 0.223170
H 5.788502 -2.331367 1.102763
H 7.098999 -1.250245 1.547670
H 5.763104 3.455767 -0.656824
H 4.469152 2.405288 -1.244434
H 6.151568 2.000330 -1.579432
H 1.613647 -2.648327 -0.594593
H 0.648173 1.386826 0.667856
H -0.596004 -2.033555 -0.211811
H -2.805602 -1.775832 -0.227256
H -3.200274 1.928289 -0.195602
H -7.364828 -0.800463 -0.049640
H -4.714813 -2.788424 -0.936313
H -6.180554 -2.797304 0.035613
H -4.622256 -2.724511 0.846864
H -5.413674 3.030096 -0.190180
H -7.500654 1.669905 -0.119509


%chk=000295343-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295343

0 1
O -1.444374 1.333590 0.129014
N 5.142807 0.186551 0.036316
N -0.487565 -0.799738 -0.162334
N -2.807966 -0.588847 -0.094251
C 3.756255 -0.038795 -0.012899
C 6.108907 -0.884817 -0.262059
C 5.695801 1.506140 0.391735
C 3.214299 -1.346816 -0.220784
C 2.814633 1.026942 0.142520
C 0.906687 -0.490439 -0.107301
C 6.476043 -1.757072 0.963963
C 5.851079 2.466439 -0.812921
C 1.825178 -1.558636 -0.270496
C 1.424843 0.813261 0.102187
C -4.114361 -0.027500 -0.034824
C -5.220528 -0.935949 -0.106572
C -1.567823 0.082636 -0.030017
C -4.344384 1.368857 0.088731
C -6.530571 -0.408078 -0.052512
C -5.001461 -2.435073 -0.238076
C -5.665359 1.860279 0.139084
C -6.767331 0.979918 0.069157
H 7.027995 -0.413620 -0.660348
H 5.716142 -1.520945 -1.077878
H 5.064213 1.973179 1.170843
H 6.686241 1.344569 0.859179
H 3.873281 -2.212635 -0.330703
H 3.164210 2.053505 0.284033
H 7.208166 -2.537596 0.683267
H 5.582136 -2.251378 1.382525
H 6.923117 -1.138154 1.763067
H 6.274361 3.435350 -0.487443
H 4.877476 2.657285 -1.296700
H 6.526880 2.034560 -1.573527
H 1.453680 -2.580748 -0.429160
H 0.733102 1.649048 0.219838
H -0.692197 -1.787560 -0.326570
H -2.784570 -1.605966 -0.179927
H -3.487309 2.041371 0.146568
H -7.378749 -1.101589 -0.106810
H -4.456712 -2.701086 -1.167732
H -5.967169 -2.965655 -0.272325
H -4.435722 -2.854686 0.619549
H -5.827983 2.939775 0.234476
H -7.792497 1.363120 0.108819


