%chk=000209583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209583

0 1
O 0.187418 1.481453 -1.656709
N 3.158232 -0.069842 -0.096885
N -0.291073 -1.282578 -0.153290
C 1.158819 0.456729 -1.426599
C 1.994035 0.851420 -0.188912
C 0.498438 -0.936298 -1.363656
C 4.324372 0.501234 0.644615
C -1.566420 -0.618933 -0.011050
C -2.613638 -0.937827 -0.913903
C -1.826119 0.251392 1.076629
C 5.490144 -0.487345 0.507501
C 4.029947 0.788793 2.127261
C -3.870552 -0.340759 -0.750317
C -3.099280 0.820488 1.221901
C -2.416726 -1.919114 -2.023061
C -0.783326 0.564739 2.102755
C -4.112706 0.537361 0.307114
H 1.793240 0.525931 -2.346403
H 1.357859 0.873972 0.729088
H 2.342466 1.899514 -0.337830
H -0.153314 -1.046681 -2.267880
H 1.291193 -1.715452 -1.460565
H 4.601861 1.463426 0.137035
H 2.869369 -0.960530 0.318344
H 0.285768 -1.182822 0.687345
H 6.418500 -0.056744 0.896135
H 5.308945 -1.423326 1.045495
H 5.659299 -0.746018 -0.546817
H 3.245357 1.541597 2.247269
H 4.922322 1.170643 2.636167
H 3.716896 -0.110527 2.666378
H -0.555114 1.429211 -1.018034
H -4.671503 -0.572041 -1.450875
H -3.299317 1.490035 2.056459
H -2.030474 -2.874006 -1.629561
H -3.340305 -2.135937 -2.571703
H -1.673969 -1.551975 -2.752900
H 0.187606 0.837679 1.647693
H -0.617696 -0.294628 2.768980
H -1.073045 1.408107 2.744736
H -5.094106 0.993862 0.421552


%chk=000209583-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209583

0 1
O 0.181269 0.847243 -2.360260
N 3.029656 -0.110625 -0.058511
N -0.260104 -1.403894 -0.154615
C 1.201967 -0.039396 -1.766772
C 1.932348 0.702872 -0.624852
C 0.599208 -1.412291 -1.358463
C 4.125029 0.626808 0.630343
C -1.443925 -0.644545 0.045842
C -2.482198 -0.550434 -0.942267
C -1.631041 -0.023987 1.332297
C 5.242349 -0.372206 0.991870
C 3.660268 1.428544 1.877664
C -3.628199 0.230305 -0.649764
C -2.804092 0.721441 1.582826
C -2.432179 -1.312111 -2.255673
C -0.583776 -0.172131 2.424700
C -3.799164 0.874817 0.593275
H 1.915733 -0.218469 -2.590563
H 1.173220 1.036088 0.124535
H 2.369774 1.621009 -1.057873
H 0.056291 -1.809021 -2.230817
H 1.432915 -2.110406 -1.156117
H 4.526975 1.345934 -0.112244
H 2.681897 -0.877061 0.536667
H 0.251456 -1.590352 0.708893
H 6.102784 0.146043 1.451947
H 4.876870 -1.124836 1.718811
H 5.588269 -0.904791 0.089441
H 2.843390 2.127668 1.621448
H 4.492676 2.021026 2.301404
H 3.295026 0.742931 2.667770
H -0.519166 1.031573 -1.680133
H -4.412834 0.304630 -1.412856
H -2.931015 1.193226 2.564891
H -2.136735 -2.365561 -2.092900
H -3.426959 -1.309612 -2.733239
H -1.715312 -0.866200 -2.971619
H 0.416404 0.182238 2.100734
H -0.470285 -1.224316 2.759852
H -0.866987 0.415747 3.313725
H -4.698400 1.466305 0.794103


