%chk=000249652.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249652

0 1
O 1.712779 1.986143 0.207595
N 2.786936 0.118471 1.058500
N 0.456581 0.046045 0.418545
C 4.867546 -0.940714 -0.747765
C 4.718263 0.565441 -0.496908
C 3.535882 -1.675063 -0.537015
C 4.082389 0.848509 0.873299
C 2.951888 -1.349442 0.847686
C 1.654799 0.802085 0.497610
C -0.821973 0.559879 0.040846
C -1.952256 -0.346131 0.120199
C -3.225815 0.135875 -0.282058
C -0.995004 1.855953 -0.406447
C -1.848455 -1.695141 0.583946
C -3.370882 1.480741 -0.744185
C -2.279753 2.311111 -0.799263
C -4.359133 -0.739205 -0.217222
C -2.948957 -2.513813 0.638175
C -4.224404 -2.028551 0.229961
H 5.233977 -1.115478 -1.777268
H 5.639329 -1.359978 -0.073695
H 5.703020 1.064340 -0.561140
H 4.096060 1.023126 -1.293149
H 2.817731 -1.385922 -1.329610
H 3.680606 -2.766325 -0.639110
H 4.754298 0.530562 1.699404
H 3.899580 1.942091 0.998394
H 1.986320 -1.874004 1.005206
H 3.635321 -1.714650 1.649985
H 0.467988 -0.922568 0.760662
H -0.149983 2.552749 -0.461956
H -0.876685 -2.074630 0.901256
H -4.355786 1.828544 -1.046317
H -2.377445 3.340357 -1.146916
H -5.328823 -0.354655 -0.530897
H -2.866549 -3.539397 0.992466
H -5.082190 -2.697455 0.281485


%chk=000249652-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249652

0 1
O 1.617344 2.170208 0.162602
N 2.729949 0.130178 0.413920
N 0.359897 0.179258 0.287821
C 5.272384 -1.098072 -0.381472
C 5.093749 0.437154 -0.348614
C 3.917597 -1.784317 -0.668306
C 4.007657 0.835289 0.672727
C 2.833957 -1.342505 0.349236
C 1.567318 0.904595 0.274560
C -0.948686 0.660266 0.021642
C -2.049865 -0.281000 0.155835
C -3.393762 0.178321 -0.142136
C -1.202990 1.985837 -0.371033
C -1.884905 -1.646160 0.571035
C -3.612666 1.533907 -0.550840
C -2.532970 2.410274 -0.656026
C -4.490844 -0.738298 -0.020073
C -2.973486 -2.515852 0.682703
C -4.293458 -2.059682 0.381706
H 6.017472 -1.390125 -1.144752
H 5.661835 -1.444365 0.598801
H 6.043909 0.935588 -0.077769
H 4.800297 0.803667 -1.351203
H 3.577873 -1.517895 -1.688001
H 4.018315 -2.886052 -0.626373
H 4.353825 0.579160 1.698077
H 3.795144 1.915027 0.635962
H 1.873611 -1.791435 0.042745
H 3.090575 -1.743691 1.354624
H 0.416538 -0.798651 0.562466
H -0.367503 2.683337 -0.442546
H -0.896089 -2.048797 0.825890
H -4.633117 1.865637 -0.773027
H -2.695183 3.449685 -0.961998
H -5.499317 -0.374169 -0.250267
H -2.815417 -3.550684 1.005578
H -5.141788 -2.746738 0.470803


