%chk=000218132.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218132

0 1
O -0.193763 -0.073231 -2.093100
N 1.945382 0.977668 0.220069
N 4.832519 0.699610 0.274654
C 2.771955 1.684613 1.251464
C 2.734228 0.823467 -1.045998
C 0.642660 1.672582 -0.025747
C 4.039798 0.854320 1.539530
C 4.001619 -0.004310 -0.758579
C -0.485062 0.629993 0.190106
C -1.819042 1.327337 0.299488
C 6.088628 -0.063759 0.539650
C -0.505391 -0.379649 -0.961936
C -0.913402 -1.777850 -0.616304
C -2.447258 1.437530 1.549098
C -2.429145 1.883010 -0.835891
C -3.675534 2.095643 1.658639
C -3.657084 2.538174 -0.720570
C -2.001509 -2.033386 0.228665
C -0.193161 -2.843644 -1.175301
C -4.283052 2.645858 0.525859
C -2.361626 -3.352105 0.518890
C -0.549999 -4.160871 -0.874154
C -1.633939 -4.414960 -0.027612
H 2.172700 1.772254 2.182000
H 3.063662 2.711660 0.940063
H 3.020280 1.799433 -1.495610
H 2.098548 0.290708 -1.790059
H 0.562888 2.091555 -1.053827
H 0.483012 2.523807 0.668519
H 4.669172 1.392762 2.279191
H 3.752729 -0.119476 1.992507
H 3.715395 -1.034658 -0.455542
H 4.602675 -0.086628 -1.688948
H -0.254221 0.072673 1.137410
H 6.672790 -0.123722 -0.392810
H 5.942410 -1.084183 0.922729
H 6.700856 0.495419 1.265148
H -1.978788 1.016573 2.436810
H -1.942437 1.798474 -1.810155
H -4.159479 2.180224 2.630399
H -4.127540 2.965858 -1.605066
H -2.575691 -1.207381 0.651604
H 0.641033 -2.636384 -1.848083
H -5.239687 3.156821 0.613336
H -3.210462 -3.551744 1.170582
H 0.012708 -4.987862 -1.303729
H -1.914277 -5.441721 0.204111


%chk=000218132-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218132

0 1
O -0.058348 -0.248306 -2.046516
N 1.999011 1.049408 0.029150
N 4.837593 0.718258 0.440831
C 2.605993 1.288559 1.356813
C 2.959156 1.321823 -1.065390
C 0.669464 1.673439 -0.145232
C 3.872512 0.432351 1.528506
C 4.220172 0.460969 -0.883411
C -0.463661 0.659243 0.183494
C -1.837881 1.339492 0.214240
C 6.111066 -0.004119 0.617884
C -0.434358 -0.482037 -0.858970
C -0.881678 -1.860188 -0.464441
C -2.477213 1.612691 1.450537
C -2.467319 1.758926 -0.987080
C -3.717989 2.287555 1.489713
C -3.708402 2.431910 -0.949754
C -1.556502 -2.128556 0.756850
C -0.629664 -2.931685 -1.364875
C -4.339085 2.698810 0.287787
C -1.967685 -3.441734 1.070404
C -1.030176 -4.243651 -1.046559
C -1.701110 -4.502659 0.173718
H 1.875454 1.020409 2.144188
H 2.878891 2.365555 1.495390
H 3.263366 2.398007 -1.095636
H 2.472000 1.065747 -2.023231
H 0.549924 1.990621 -1.196297
H 0.539630 2.575838 0.494689
H 4.350827 0.668865 2.498081
H 3.576066 -0.648566 1.541133
H 3.936212 -0.616479 -1.000131
H 4.955263 0.711038 -1.671506
H -0.253282 0.236303 1.183239
H 6.817256 0.285634 -0.181118
H 5.997650 -1.118439 0.590836
H 6.562633 0.269233 1.588881
H -1.996239 1.302751 2.387593
H -1.986747 1.548067 -1.949562
H -4.198305 2.492616 2.453320
H -4.184457 2.746612 -1.885392
H -1.786148 -1.314774 1.451402
H -0.117525 -2.704037 -2.305574
H -5.302473 3.220131 0.315576
H -2.496990 -3.638580 2.009118
H -0.824517 -5.064001 -1.742945
H -2.016285 -5.522548 0.421746


