%chk=000182466.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182466

0 1
O -1.222317 0.426395 1.448120
N -1.555696 -0.478184 0.593306
N 1.320600 0.711029 0.323753
C -0.240854 0.097879 -1.580673
C -1.613228 0.018476 -0.881403
C 0.656203 -1.680041 -0.108267
C 0.365188 -1.315330 -1.570205
C 1.725809 -0.712593 0.473569
C -0.644539 -1.721132 0.718475
C 0.774998 1.106882 -1.007083
C -2.408634 1.329946 -0.875515
C -3.018261 -0.933180 0.907800
C 3.111994 -1.038741 -0.147537
C -3.865007 1.038754 -0.479471
C -3.924116 0.304704 0.868775
C 2.392482 1.636219 0.787371
C 4.189536 -0.085640 0.382419
C 3.779797 1.376956 0.170523
H -0.440618 0.406822 -2.638545
H -2.200600 -0.753357 -1.451064
H 1.084244 -2.713857 -0.067114
H -0.313206 -2.049021 -2.037913
H 1.296714 -1.341390 -2.167213
H 1.786950 -0.880623 1.583892
H -1.215291 -2.626914 0.440620
H -0.385208 -1.794764 1.799925
H 1.572292 1.269092 -1.765964
H 0.263417 2.084792 -0.846597
H -2.356871 1.831232 -1.854598
H -1.946768 2.019625 -0.127269
H -3.026474 -1.366454 1.927297
H -3.350023 -1.707317 0.197139
H 3.056910 -0.961258 -1.249560
H 3.390673 -2.082787 0.076216
H -4.365466 0.443398 -1.264925
H -4.429027 1.987977 -0.408395
H -3.581124 1.000718 1.671488
H -4.961638 0.018021 1.111514
H 2.443127 1.525310 1.895364
H 2.073157 2.682388 0.601049
H 5.152958 -0.287744 -0.120856
H 4.361072 -0.273575 1.460235
H 4.525622 2.053631 0.624109
H 3.766924 1.614457 -0.908790


%chk=000182466-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182466

0 1
O -0.992750 0.418094 1.372692
N -1.522878 -0.557032 0.464391
N 1.856662 0.681452 -0.641193
C -0.394817 0.266154 -1.706425
C -1.739754 0.036093 -0.969868
C 0.701309 -1.538644 -0.410980
C 0.340249 -1.086406 -1.843445
C 1.695635 -0.515916 0.245636
C -0.591055 -1.777975 0.397316
C 0.560812 1.307963 -1.034775
C -2.640933 1.273030 -0.837381
C -2.897635 -1.022023 0.998204
C 3.083223 -1.161765 0.466397
C -4.014685 0.904652 -0.228298
C -3.831281 0.187511 1.130023
C 2.761490 1.689198 -0.036325
C 4.088939 -0.159545 1.074863
C 4.170075 1.109022 0.196142
H -0.678938 0.634905 -2.712012
H -2.287533 -0.757168 -1.525867
H 1.205694 -2.525458 -0.456482
H -0.307123 -1.836900 -2.341784
H 1.256800 -0.961705 -2.442466
H 1.272282 -0.199128 1.228410
H -1.161051 -2.612258 -0.061028
H -0.373696 -2.012386 1.452941
H 0.802947 2.112049 -1.756234
H 0.055822 1.758338 -0.152512
H -2.764564 1.727120 -1.839632
H -2.130151 2.003643 -0.185170
H -2.686979 -1.479883 1.979107
H -3.308266 -1.785757 0.307132
H 3.465311 -1.526676 -0.509542
H 2.967030 -2.042141 1.130037
H -4.568355 0.244708 -0.929800
H -4.627292 1.815612 -0.093159
H -3.372054 0.876516 1.861088
H -4.804071 -0.153473 1.532953
H 2.351617 2.063303 0.938772
H 2.815757 2.557395 -0.721816
H 5.087311 -0.625830 1.181661
H 3.751274 0.122846 2.093517
H 4.812478 1.875182 0.672627
H 4.618847 0.854084 -0.783711


