%chk=000235687.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235687

0 1
I 2.973368 2.134811 -0.839706
O -2.236652 0.201687 -1.143429
O 3.211055 -1.044667 0.069865
O 2.389188 -0.092867 1.992700
N 0.977799 -1.121516 0.424570
C -0.301406 -0.543273 0.955482
C -0.494154 0.871237 0.458548
C -1.413620 -1.448278 0.488233
C -1.396509 1.158783 -0.574346
C -2.293845 -1.046217 -0.526890
C 0.250460 1.936897 0.988738
C -1.584653 -2.730817 1.033435
C -1.545631 2.441923 -1.122773
C -3.317906 -1.873348 -1.015498
C 0.116179 3.225015 0.465036
C -2.597436 -3.568688 0.566580
C -0.771140 3.472001 -0.592946
C -3.457497 -3.141465 -0.457118
C 2.185647 -0.648158 0.933376
C 4.468699 -0.327591 0.208244
C 4.567662 0.682981 -0.913704
H -0.232516 -0.545942 2.081034
H 0.961578 -1.425424 -0.553271
H 0.948643 1.746158 1.814598
H -0.909471 -3.070729 1.821415
H -2.251657 2.608827 -1.932907
H -3.973676 -1.515221 -1.806310
H 0.692401 4.044915 0.891693
H -2.721382 -4.561298 0.995777
H -0.863185 4.479682 -0.999805
H -4.243442 -3.806646 -0.816854
H 5.217494 -1.138349 0.097880
H 4.541863 0.124068 1.219403
H 5.516091 1.240019 -0.879432
H 4.480548 0.201790 -1.902318


%chk=000235687-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235687

0 1
I 5.237515 1.998390 -0.577540
O -2.882663 0.316799 -0.797374
O 3.211674 -0.825844 -0.226336
O 2.299536 -0.439160 1.925028
N 0.979544 -0.467165 -0.020354
C -0.316018 -0.180645 0.648474
C -0.831009 1.209438 0.279365
C -1.338202 -1.268106 0.328838
C -2.043877 1.392303 -0.425353
C -2.531349 -0.984414 -0.377657
C -0.081839 2.363140 0.620108
C -1.103870 -2.609771 0.719986
C -2.500176 2.675143 -0.800708
C -3.459212 -1.998282 -0.705493
C -0.521649 3.652274 0.260823
C -2.019098 -3.634630 0.409379
C -1.734999 3.805687 -0.457045
C -3.200050 -3.324500 -0.312057
C 2.155499 -0.558787 0.680044
C 4.562654 -0.910444 0.360763
C 5.545713 -0.195930 -0.554427
H -0.068308 -0.204663 1.726979
H 1.011353 -0.546666 -1.038518
H 0.859665 2.234931 1.167408
H -0.183509 -2.841562 1.269132
H -3.443143 2.761243 -1.348619
H -4.364383 -1.726325 -1.256441
H 0.072257 4.530350 0.533804
H -1.819319 -4.664092 0.723459
H -2.083538 4.803543 -0.743953
H -3.917071 -4.113838 -0.561704
H 4.836550 -1.984178 0.409524
H 4.545415 -0.497882 1.384206
H 6.581937 -0.339020 -0.210772
H 5.436867 -0.507038 -1.603669


