%chk=000211088.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211088

0 1
O 2.026834 2.721609 0.625757
N -2.449363 1.157516 0.275904
N 0.507697 1.546742 -0.600745
N -4.222465 0.103881 -0.721872
C -1.540200 2.242716 0.667320
C -2.199103 -0.224231 0.384748
C -0.530185 2.585292 -0.451793
C -3.325722 -0.870205 -0.237855
C -3.682538 1.293615 -0.420182
C -1.149722 -0.966953 0.957239
C -3.394236 -2.276955 -0.284337
C -1.246817 -2.346039 0.891941
C -2.353388 -2.993381 0.278577
C 1.757486 1.701729 0.012581
C 2.694128 0.546825 -0.159163
C 3.364032 0.062170 0.973090
C 2.932190 -0.018035 -1.418763
C 4.256761 -1.005159 0.845236
C 3.830167 -1.082324 -1.540565
C 4.488127 -1.578215 -0.409893
H -0.997307 1.953318 1.599506
H -2.136924 3.148582 0.923144
H -1.052007 2.714571 -1.426581
H -0.037906 3.561892 -0.207596
H -4.114246 2.258817 -0.645564
H -0.309293 -0.473306 1.434885
H 0.207936 0.656247 -0.990265
H -4.250074 -2.760766 -0.752482
H -0.458503 -2.964342 1.321453
H -2.371721 -4.082267 0.260717
H 3.194755 0.528420 1.945506
H 2.431554 0.375721 -2.303401
H 4.777415 -1.385641 1.723171
H 4.019427 -1.523386 -2.518386
H 5.186313 -2.409259 -0.507932


%chk=000211088-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211088

0 1
O 1.853047 2.384969 1.373212
N -2.432132 1.150514 0.161959
N 0.540031 1.700489 -0.412962
N -4.069192 0.179812 -1.129007
C -1.623872 2.217683 0.769607
C -2.200940 -0.237742 0.222713
C -0.480730 2.719694 -0.150936
C -3.234138 -0.827386 -0.586891
C -3.556452 1.327127 -0.660808
C -1.235546 -1.017228 0.897235
C -3.302575 -2.232240 -0.734623
C -1.324560 -2.416435 0.738211
C -2.339788 -3.015569 -0.066684
C 1.656694 1.580102 0.405563
C 2.620163 0.470695 0.075739
C 3.951583 0.602222 0.547334
C 2.249069 -0.694800 -0.646546
C 4.906241 -0.399193 0.276732
C 3.205678 -1.699070 -0.912058
C 4.537011 -1.550852 -0.458862
H -1.194813 1.851997 1.718219
H -2.289405 3.067148 1.010153
H -0.898767 3.069125 -1.112072
H 0.017705 3.567611 0.352038
H -3.959985 2.317572 -0.869268
H -0.452850 -0.571736 1.519822
H 0.424859 1.078689 -1.213076
H -4.088257 -2.683323 -1.348330
H -0.596519 -3.057266 1.247890
H -2.370167 -4.106541 -0.160412
H 4.208303 1.494570 1.127463
H 1.212139 -0.855614 -0.966548
H 5.934030 -0.285885 0.638301
H 2.909667 -2.599146 -1.461672
H 5.277570 -2.330795 -0.668038


