%chk=000181755.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181755

0 1
O -5.494928 1.281105 0.834420
O 6.016533 0.348394 0.102741
N -5.086303 1.782670 -1.333550
N 4.818777 2.235103 -0.253811
C -0.018174 -2.186643 -0.058495
C -1.247053 -1.318138 -0.102556
C 1.253235 -1.380247 -0.052887
C -2.171246 -1.450179 -1.149697
C 1.517425 -0.480573 -1.099374
C -1.482507 -0.385206 0.921062
C 2.187825 -1.538795 0.980866
C -3.545551 0.280058 -0.159233
C 3.628669 0.101499 -0.068809
C -3.319227 -0.654591 -1.176395
C 2.700708 0.257611 -1.107662
C -2.630049 0.406300 0.896725
C 3.376467 -0.805606 0.968803
C -4.775296 1.130134 -0.137674
C 4.920088 0.855232 -0.059562
H 0.007971 -2.890847 -0.920517
H -0.077914 -2.846987 0.836356
H -2.002260 -2.176969 -1.942321
H 0.793912 -0.359676 -1.904709
H -0.766832 -0.282308 1.736505
H 1.996480 -2.238308 1.793207
H -4.042102 -0.774894 -1.983879
H 2.907152 0.944436 -1.929025
H -2.827265 1.119107 1.701060
H 4.115716 -0.942060 1.761668
H -5.883007 2.400108 -1.370198
H -4.481516 1.782105 -2.133119
H 5.650124 2.804927 -0.216588
H 3.942348 2.721335 -0.286553


%chk=000181755-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181755

0 1
O -5.164036 1.971201 0.839488
O 6.119971 0.215590 0.794126
N -5.732090 1.246758 -1.282578
N 5.266675 2.046576 -0.336135
C -0.016610 -2.048568 -0.155390
C -1.274068 -1.184301 -0.195787
C 1.299407 -1.278558 -0.055518
C -2.266208 -1.394118 -1.185141
C 1.555336 -0.158822 -0.888660
C -1.499672 -0.177456 0.780430
C 2.315678 -1.696794 0.840589
C -3.664183 0.386814 -0.233523
C 3.797613 0.105122 0.080415
C -3.447612 -0.621344 -1.206675
C 2.786343 0.524258 -0.823889
C -2.677138 0.591758 0.765172
C 3.549654 -1.019744 0.905113
C -4.896706 1.254288 -0.174510
C 5.142121 0.776284 0.208542
H 0.005573 -2.685517 -1.062284
H -0.081598 -2.745220 0.703990
H -2.116558 -2.174469 -1.941386
H 0.782759 0.176810 -1.590010
H -0.742645 0.002065 1.552701
H 2.137584 -2.560921 1.492302
H -4.200556 -0.841150 -1.973397
H 2.956782 1.363628 -1.509142
H -2.867700 1.361115 1.520583
H 4.344551 -1.341874 1.585615
H -6.571990 1.822645 -1.242564
H -5.513034 0.751654 -2.143431
H 6.174145 2.504727 -0.262728
H 4.480415 2.565659 -0.719517


