%chk=000232196.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232196

0 1
O 0.333664 2.167053 0.572662
O -2.715568 -0.793391 -0.846534
O -0.355071 1.768636 -1.544833
O -3.012570 0.748152 0.787019
O -0.786992 -2.327424 1.808497
N -0.360308 -0.079694 1.600221
N 5.583398 -1.228178 -0.666053
C -0.719291 0.045568 0.177774
C -0.138738 -1.077184 -0.712001
C 1.360316 -1.123822 -0.712337
C -0.247722 1.405520 -0.400041
C -2.279342 0.072811 0.108182
C 2.038524 -1.999298 0.150511
C 2.099249 -0.315175 -1.590534
C -0.421306 -1.285008 2.319969
C 3.429672 -2.064470 0.150747
C 3.490798 -0.365883 -1.605303
C 4.165667 -1.239555 -0.726097
C 0.820152 3.505067 0.207949
C -4.164036 -0.908858 -1.063603
C -0.002326 -1.153437 3.756705
C -0.348599 4.458756 0.109184
C -4.656125 0.279093 -1.860178
H -0.530826 -0.950287 -1.747434
H -0.564109 -2.054341 -0.367092
H -0.069552 0.786852 2.063944
H 1.465753 -2.642189 0.824698
H 1.578443 0.361370 -2.272793
H 3.941486 -2.741593 0.828410
H 4.050150 0.270718 -2.284662
H 1.490899 3.711857 1.062106
H 1.391503 3.421024 -0.733478
H -4.204506 -1.862659 -1.621606
H -4.657324 -1.004392 -0.080397
H 1.034162 -0.804995 3.862418
H -0.066666 -2.135128 4.255387
H -0.649574 -0.466698 4.319927
H -0.975118 4.236880 -0.768638
H -1.001584 4.394034 0.990568
H -0.013026 5.498867 0.018398
H -4.626550 1.202258 -1.261653
H -4.034990 0.453831 -2.749520
H -5.689688 0.137195 -2.197043
H 6.015841 -2.061721 -0.293568
H 6.057630 -0.902159 -1.496279


%chk=000232196-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232196

0 1
O 0.392685 2.095608 0.487861
O -2.762776 -0.791338 -0.943103
O -0.579238 1.694729 -1.591079
O -2.977741 0.518682 0.971805
O -1.413556 -2.140809 1.916210
N -0.257761 -0.167554 1.541402
N 5.713672 -1.218803 -0.700992
C -0.704075 -0.057692 0.147876
C -0.078724 -1.168392 -0.778120
C 1.439545 -1.181840 -0.761153
C -0.312861 1.324455 -0.428091
C -2.272509 -0.085474 0.134938
C 2.156467 -1.981597 0.166535
C 2.196019 -0.401361 -1.674763
C -0.662430 -1.209513 2.349381
C 3.564632 -1.999458 0.194707
C 3.604718 -0.405871 -1.661215
C 4.315527 -1.205690 -0.720193
C 0.820775 3.459621 0.033502
C -4.254480 -0.839954 -1.080220
C -0.176234 -1.154565 3.792068
C -0.302201 4.474324 0.256563
C -4.766221 0.397509 -1.821290
H -0.465876 -0.990587 -1.794641
H -0.490953 -2.127200 -0.422715
H 0.314317 0.597357 1.903385
H 1.599265 -2.614975 0.867904
H 1.670727 0.210296 -2.419216
H 4.090336 -2.636561 0.917314
H 4.161599 0.199921 -2.387417
H 1.707569 3.668067 0.652457
H 1.104081 3.391044 -1.030995
H -4.425788 -1.768419 -1.647286
H -4.691093 -0.922595 -0.069840
H 0.657443 -0.447538 3.943852
H 0.140733 -2.162664 4.105356
H -1.017503 -0.853945 4.442227
H -1.173940 4.240699 -0.376785
H -0.621833 4.486545 1.312421
H 0.056722 5.485877 -0.009531
H -4.589590 1.310103 -1.228268
H -4.266570 0.505175 -2.799148
H -5.854371 0.301809 -1.994429
H 6.219199 -1.811858 -0.050061
H 6.248093 -0.677567 -1.373614


