%chk=000202995.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202995

0 1
O 3.545484 -1.978377 -0.277316
N -1.396663 -0.744508 -0.223649
C -1.444470 1.642860 -0.837076
C -0.624770 0.316917 -0.974342
C -2.036562 0.011016 0.909938
C -2.399163 1.415342 0.356910
C -0.554887 2.880308 -0.693350
C -3.203354 -0.715772 1.592779
C -2.358830 -1.438170 -1.142234
C 0.780705 0.350601 -0.399954
C -4.164864 -1.384211 0.606263
C -3.373466 -2.277331 -0.354411
C 0.470153 2.722146 0.434104
C 1.311151 1.492484 0.241300
C 1.570792 -0.790353 -0.546440
C 2.625697 1.471656 0.718530
C 2.889490 -0.782999 -0.053999
C 3.434476 0.338533 0.577650
C 4.903058 -2.100203 0.206286
H -2.055333 1.764694 -1.762326
H -0.532598 0.051400 -2.057124
H -1.214102 0.130482 1.668932
H -2.287763 2.185734 1.133895
H -3.449840 1.455685 0.029477
H -1.178837 3.776174 -0.515511
H -0.023918 3.062786 -1.649332
H -3.749950 -0.006943 2.241827
H -2.785284 -1.489919 2.269472
H -1.747353 -2.102685 -1.792687
H -2.902765 -0.733479 -1.807952
H -4.729802 -0.619432 0.040729
H -4.917594 -1.980390 1.154383
H -2.843101 -3.067638 0.214193
H -4.051476 -2.798548 -1.053691
H -0.048867 2.650958 1.413895
H 1.103223 3.629409 0.491643
H 1.175518 -1.695119 -1.006407
H 3.036279 2.351768 1.212521
H 4.449564 0.346792 0.954609
H 5.157676 -3.124967 -0.093046
H 4.930750 -1.992254 1.294272
H 5.551094 -1.373848 -0.291959


%chk=000202995-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202995

0 1
O 3.557901 -2.054829 -0.085397
N -1.451667 -0.782184 -0.355058
C -1.478153 1.621699 -0.824664
C -0.637286 0.301302 -1.008039
C -1.951220 -0.108772 0.895070
C -2.328882 1.353594 0.462936
C -0.608689 2.897471 -0.798251
C -3.041237 -0.918576 1.625786
C -2.540845 -1.264257 -1.254850
C 0.775092 0.363973 -0.410550
C -4.148269 -1.435405 0.679138
C -3.505916 -2.197546 -0.500784
C 0.488307 2.820843 0.283551
C 1.320230 1.550288 0.161431
C 1.559915 -0.808040 -0.464248
C 2.649480 1.518417 0.644677
C 2.882838 -0.823681 0.029188
C 3.443103 0.352157 0.587818
C 4.930438 -2.117917 0.415600
H -2.165012 1.698207 -1.689742
H -0.540028 0.051399 -2.082597
H -1.072818 -0.037827 1.567361
H -2.099861 2.072956 1.270420
H -3.409627 1.441609 0.246093
H -1.249044 3.785140 -0.629180
H -0.129498 3.029003 -1.789561
H -3.471680 -0.293740 2.432419
H -2.562083 -1.790009 2.114047
H -2.064791 -1.798459 -2.099018
H -3.142159 -0.426368 -1.691815
H -4.747012 -0.589150 0.284097
H -4.846112 -2.087930 1.237258
H -2.943126 -3.071615 -0.119022
H -4.279008 -2.571071 -1.199242
H 0.013501 2.856993 1.286874
H 1.144529 3.710176 0.225830
H 1.134056 -1.730603 -0.870479
H 3.077748 2.430659 1.079492
H 4.468375 0.372352 0.969368
H 5.256752 -3.152620 0.232748
H 4.976943 -1.899709 1.501031
H 5.594316 -1.417331 -0.128937


