%chk=000218351.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218351

0 1
O -1.883878 -0.709267 1.450199
N 2.415102 0.736836 -0.119821
N 5.307699 0.760937 0.149310
C 0.081316 0.051794 0.426924
C -1.247655 0.536235 1.089905
C 1.032281 1.244999 0.160695
C -0.141437 -0.725893 -0.885414
C 3.086364 0.267087 1.137122
C 3.248252 1.806983 -0.762975
C -0.982237 1.305517 2.409671
C 4.473406 -0.308949 0.791207
C 4.637321 1.232693 -1.107799
C -2.142105 1.309321 0.129261
C -0.684554 -2.116417 -0.701646
C -2.257961 1.779677 3.095398
C -1.925524 2.670314 -0.128356
C -3.193416 0.646174 -0.520995
C 6.674816 0.241843 -0.154418
C -1.851324 -2.511543 -1.375704
C -0.002309 -3.051477 0.095299
C -2.751896 3.357380 -1.022757
C -4.019542 1.334643 -1.412027
C -3.800599 2.692621 -1.665296
C -2.334162 -3.816204 -1.241703
C -0.490785 -4.352571 0.227777
C -1.657758 -4.739896 -0.439885
H 0.560246 -0.644088 1.165823
H 0.672609 1.803377 -0.732534
H 1.004383 1.963198 1.011303
H 0.840560 -0.806159 -1.412589
H -0.787863 -0.136149 -1.565850
H 2.457126 -0.531797 1.588151
H 3.195680 1.073240 1.895073
H 2.743968 2.127127 -1.699368
H 3.366753 2.706984 -0.120973
H -0.423535 0.632839 3.093045
H -0.311168 2.167209 2.218242
H 4.980519 -0.630829 1.725194
H 4.354737 -1.209472 0.149829
H 4.529870 0.429385 -1.869098
H 5.263482 2.033149 -1.555420
H -2.684038 -0.543850 1.990594
H -2.926524 0.943051 3.332833
H -2.031402 2.291164 4.038359
H -2.822262 2.482452 2.468191
H -1.118757 3.203157 0.370780
H -3.351327 -0.419713 -0.330247
H 7.279756 1.056804 -0.583238
H 7.161420 -0.056136 0.788220
H 6.706085 -0.613291 -0.845431
H -2.384114 -1.800980 -2.003260
H 0.907127 -2.757188 0.614184
H -2.577944 4.413947 -1.217839
H -4.833624 0.811890 -1.911165
H -4.443279 3.229183 -2.359986
H -3.240809 -4.113225 -1.764768
H 0.039038 -5.068737 0.852536
H -2.035533 -5.753076 -0.335262


%chk=000218351-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218351

0 1
O -2.696517 -0.282763 1.201554
N 2.015652 0.496995 0.019238
N 4.872191 -0.026948 0.187344
C -0.436707 0.159607 0.556175
C -1.762744 0.865901 1.031230
C 0.743652 1.153954 0.404917
C -0.630318 -0.675612 -0.753033
C 2.583552 -0.349594 1.100101
C 3.019529 1.495053 -0.431409
C -1.568510 1.533493 2.427446
C 3.879009 -1.032756 0.635185
C 4.305854 0.799718 -0.903157
C -2.337176 1.852091 -0.009295
C -0.171101 -2.124669 -0.637489
C -2.874749 2.017843 3.094846
C -1.866967 3.189952 -0.107605
C -3.355226 1.436861 -0.907380
C 6.162998 -0.637522 -0.180545
C -0.835417 -3.014282 0.250251
C 0.901085 -2.624142 -1.418542
C -2.392194 4.078412 -1.071176
C -3.884547 2.324340 -1.871093
C -3.405108 3.650249 -1.959651
C -0.437771 -4.366232 0.350120
C 1.299543 -3.977981 -1.323381
C 0.631625 -4.855241 -0.438091
H -0.210074 -0.543028 1.382221
H 0.492734 1.875173 -0.396519
H 0.879222 1.739846 1.350828
H -0.082212 -0.182459 -1.574820
H -1.702173 -0.673461 -1.017671
H 1.852820 -1.131265 1.370530
H 2.801905 0.260771 2.013955
H 2.587250 2.077652 -1.266847
H 3.283545 2.208618 0.390875
H -1.072583 0.790653 3.081710
H -0.875925 2.389924 2.341708
H 4.310548 -1.606443 1.476848
H 3.628653 -1.755264 -0.182151
H 4.071160 0.181559 -1.808633
H 5.051190 1.563823 -1.194947
H -3.561114 0.068763 1.536704
H -3.545725 1.177165 3.356276
H -2.648300 2.543851 4.039669
H -3.427839 2.719504 2.444341
H -1.091155 3.552776 0.575521
H -3.732360 0.410859 -0.844537
H 6.886541 0.153227 -0.450112
H 6.570411 -1.194112 0.682771
H 6.088281 -1.347545 -1.044045
H -1.669293 -2.631086 0.851077
H 1.430174 -1.939878 -2.092426
H -2.013311 5.105461 -1.124921
H -4.669581 1.978051 -2.553054
H -3.815222 4.339770 -2.705959
H -0.963857 -5.040788 1.036317
H 2.128901 -4.347465 -1.938318
H 0.938340 -5.905072 -0.363648


