%chk=000214118.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214118

0 1
O -0.434353 0.612973 -0.143995
N -4.295760 1.364073 0.317167
N 2.315499 1.685026 3.554804
C -4.125621 0.501719 -0.907064
C -3.790169 0.446276 1.400656
C -4.560529 -0.933383 -0.479336
C -4.341736 -0.969004 1.047843
C -2.620257 0.556408 -1.246732
C -2.251495 0.489350 1.299689
C -1.764358 0.021604 -0.083032
C -5.700204 1.807841 0.532307
C 0.445865 0.089115 -1.159496
C 1.696028 0.940591 -1.067545
C 0.788036 -1.371325 -0.927943
C 2.443119 1.040468 0.120768
C 1.317582 -1.820866 0.295608
C 2.116485 1.634348 -2.214034
C 0.576642 -2.287320 -1.970485
C 2.037414 0.335060 1.353791
C 1.550831 -0.921006 1.430434
C 3.607851 1.832676 0.138749
C 1.618792 -3.188100 0.458577
C 3.272484 2.413538 -2.185965
C 0.887467 -3.636617 -1.803697
C 4.020831 2.510678 -1.006367
C 1.410492 -4.087347 -0.585122
C 2.195119 1.084617 2.573989
H -4.725893 0.879978 -1.759492
H -4.118002 0.781428 2.406022
H -3.977154 -1.708681 -0.996208
H -5.615119 -1.114002 -0.736850
H -5.282937 -1.165414 1.583203
H -3.643385 -1.764599 1.345253
H -2.417459 -0.000625 -2.174330
H -2.332794 1.613276 -1.436064
H -1.899250 1.533173 1.461555
H -1.786251 -0.115491 2.095166
H -1.666893 -1.082610 -0.129856
H -6.439413 0.998982 0.621356
H -5.996774 2.461490 -0.303868
H -5.740408 2.419146 1.448719
H -0.060877 0.224704 -2.145391
H 1.534474 1.568593 -3.132628
H 0.169869 -1.943354 -2.921071
H 1.299194 -1.350148 2.408657
H 4.194167 1.915679 1.054874
H 2.028334 -3.541869 1.404417
H 3.591440 2.949195 -3.078762
H 0.724082 -4.339594 -2.618954
H 4.924007 3.119135 -0.982739
H 1.654591 -5.140783 -0.454277


%chk=000214118-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214118

0 1
O -0.343317 0.817594 -0.051474
N -4.476380 1.223916 0.098674
N 3.409386 1.060736 3.630063
C -4.053416 0.257571 -0.964730
C -3.869345 0.599497 1.319641
C -4.314450 -1.169458 -0.349962
C -4.190974 -0.937260 1.194687
C -2.547006 0.502891 -1.244567
C -2.346220 0.878709 1.276300
C -1.706195 0.237183 0.029320
C -5.941965 1.418612 0.186358
C 0.539034 0.233829 -1.092047
C 1.833452 1.022724 -1.026250
C 0.722446 -1.269647 -0.923977
C 2.647460 1.059106 0.148811
C 1.246586 -1.828198 0.286132
C 2.195099 1.811332 -2.143763
C 0.275539 -2.137383 -1.948311
C 2.404485 0.208978 1.339105
C 1.806820 -1.040225 1.380449
C 3.771897 1.936217 0.168588
C 1.237236 -3.247733 0.442333
C 3.328913 2.649006 -2.122117
C 0.313534 -3.540186 -1.796526
C 4.115508 2.717784 -0.949042
C 0.786194 -4.097380 -0.583919
C 2.957358 0.675846 2.590640
H -4.635697 0.432745 -1.886620
H -4.303646 1.049777 2.229127
H -3.590554 -1.916127 -0.723219
H -5.323749 -1.529303 -0.618357
H -5.137488 -1.180725 1.709341
H -3.399914 -1.557511 1.652518
H -2.215835 -0.147886 -2.077855
H -2.414909 1.558268 -1.546651
H -2.188294 1.970877 1.231670
H -1.849113 0.496772 2.187287
H -1.611776 -0.858658 0.182669
H -6.532313 0.488112 0.369512
H -6.303562 1.870256 -0.754817
H -6.162048 2.126792 1.004992
H 0.082173 0.405816 -2.089132
H 1.557519 1.785186 -3.035373
H -0.122524 -1.702945 -2.873812
H 1.835820 -1.552025 2.352006
H 4.391311 1.987393 1.070769
H 1.620313 -3.678654 1.375205
H 3.582933 3.256299 -2.997331
H -0.039790 -4.191527 -2.603182
H 4.990067 3.375527 -0.906205
H 0.802997 -5.183517 -0.444656


