%chk=000271259.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271259

0 1
O -6.988098 -0.789414 0.520052
O -0.755308 -0.644677 -0.662496
O 6.203165 -2.403443 0.370543
O -0.020392 3.344593 -0.332798
O 2.789018 2.905481 -0.221153
N 1.134153 1.360964 -0.706812
C -3.026137 -0.042946 -0.457088
C -1.237661 1.567470 -1.362106
C -1.612933 0.214067 -0.795432
C 3.382345 0.591770 -0.119527
C -0.000651 2.209494 -0.739851
C -3.403565 -1.367419 -0.164288
C -3.996235 0.980102 -0.396781
C 2.463542 1.747250 -0.318982
C -5.663918 -0.647456 0.213517
C -4.718920 -1.684453 0.167448
C -5.309836 0.694171 -0.066396
C 4.717600 0.740975 -0.551846
C 2.980679 -0.588857 0.517719
C 5.202825 -1.472684 0.260431
C 5.632200 -0.285385 -0.375345
C 3.885540 -1.633977 0.713856
C -7.482798 -2.115806 0.839489
C 5.896416 -3.665190 1.015362
H -2.070180 2.305292 -1.276889
H -1.075010 1.459098 -2.459489
H -2.642182 -2.155402 -0.200674
H -3.704031 2.014969 -0.608634
H 0.973177 0.357457 -0.933203
H -4.991617 -2.711708 0.386190
H -6.071950 1.469851 -0.011885
H 5.024774 1.679413 -1.024113
H 1.953173 -0.701365 0.875514
H 6.665658 -0.197109 -0.704548
H 3.562051 -2.542732 1.209910
H -8.544364 -1.913503 1.038511
H -7.364714 -2.781749 -0.019983
H -6.983294 -2.501878 1.732705
H 5.602737 -3.498094 2.055649
H 5.128080 -4.202392 0.452194
H 6.862562 -4.184576 0.957928


%chk=000271259-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271259

0 1
O -6.902824 -0.889932 0.723212
O -0.671191 -0.567252 -0.864605
O 6.091478 -2.452373 0.754663
O 0.059502 3.616811 -0.851475
O 2.869831 2.995312 -0.348255
N 1.119456 1.494427 -0.831076
C -2.973813 0.037474 -0.547421
C -1.220437 1.674867 -1.603063
C -1.586044 0.326345 -0.982900
C 3.317615 0.623831 -0.130246
C 0.053335 2.377343 -1.038279
C -3.265804 -1.274955 -0.076114
C -4.030996 0.996914 -0.568869
C 2.446249 1.811348 -0.428891
C -5.590397 -0.659275 0.323546
C -4.552970 -1.632157 0.354591
C -5.320416 0.656462 -0.138804
C 4.700492 0.882967 0.090319
C 2.856201 -0.715547 -0.039267
C 5.120200 -1.490830 0.462077
C 5.594633 -0.154639 0.380389
C 3.745345 -1.770885 0.255155
C -7.254615 -2.227030 1.222362
C 5.663230 -3.851553 0.854360
H -2.026560 2.416729 -1.543039
H -1.021411 1.490513 -2.679229
H -2.450038 -2.004863 -0.058604
H -3.853451 2.020018 -0.912369
H 0.850811 0.500720 -0.946064
H -4.742962 -2.649347 0.708857
H -6.135985 1.385073 -0.145856
H 5.042513 1.921064 0.028859
H 1.798395 -0.969512 -0.174454
H 6.658775 0.035302 0.548003
H 3.359417 -2.791969 0.324061
H -8.322896 -2.163165 1.472573
H -7.096752 -2.996849 0.443698
H -6.671360 -2.479657 2.127741
H 4.927974 -3.988542 1.670559
H 5.231787 -4.207795 -0.100872
H 6.579582 -4.415192 1.081423


