%chk=000251414.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251414

0 1
O 6.348758 -0.922499 0.325012
O -5.800731 -0.857768 2.242180
O 4.967649 -1.168823 2.098490
O -6.868954 -0.434674 0.295534
N 1.829383 2.941147 -1.812495
N -0.579793 0.144196 -1.162698
C -0.508532 2.289640 -2.501166
C 0.381423 3.090157 -1.538235
C -0.276985 0.769299 -2.466368
C 2.614855 2.004980 -1.127808
C -1.880461 0.028746 -0.669018
C 3.846743 1.599071 -1.707313
C -2.049010 -0.330360 0.696680
C 2.250288 1.521246 0.153534
C -3.019729 0.195983 -1.496002
C 4.319316 0.255120 0.257578
C -4.455595 -0.353133 0.385748
C 4.684496 0.738809 -1.012860
C -3.323785 -0.521990 1.206176
C 3.102326 0.662380 0.834327
C -4.287553 0.000226 -0.966381
C 5.179034 -0.667301 1.014732
C -5.820085 -0.539667 0.896442
C 7.305505 -1.847609 0.930955
C -7.081988 -1.111541 2.897556
C 6.847515 -3.275200 0.715263
C -7.562864 -2.508330 2.561219
H -1.571014 2.509261 -2.258824
H -0.366718 2.648035 -3.539947
H 0.158546 2.811273 -0.481716
H 0.139170 4.176873 -1.624915
H -0.896380 0.284008 -3.257855
H 0.784345 0.531775 -2.712872
H 2.095215 3.150861 -2.773777
H 0.188166 0.156575 -0.490841
H 4.142813 1.969790 -2.684460
H -1.183204 -0.470377 1.337699
H 1.327898 1.859364 0.621662
H -2.907916 0.455944 -2.543834
H 5.637935 0.422670 -1.449209
H -3.463779 -0.803733 2.254954
H 2.835287 0.291605 1.830053
H -5.174475 0.121222 -1.597420
H 8.223064 -1.592877 0.370528
H 7.412112 -1.593255 2.000897
H -7.798547 -0.330225 2.586494
H -6.800347 -0.990201 3.959010
H 7.614417 -3.994542 1.023967
H 5.938756 -3.489905 1.298593
H 6.608158 -3.467765 -0.337979
H -8.440110 -2.786320 3.155640
H -7.843950 -2.582608 1.499413
H -6.781167 -3.257251 2.740556


%chk=000251414-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251414

0 1
O 6.429371 -0.936754 0.518152
O -5.724650 -1.054477 2.373192
O 4.835360 -1.218230 2.207576
O -6.914939 -0.143838 0.577234
N 1.836989 2.777709 -2.002617
N -0.712541 0.306585 -1.398086
C -0.559043 2.457828 -2.738685
C 0.434798 3.148370 -1.768500
C -0.477859 0.908329 -2.714527
C 2.626183 1.932301 -1.225928
C -1.957808 0.129964 -0.803687
C 3.929497 1.573401 -1.702360
C -2.036286 -0.470047 0.494463
C 2.204628 1.407518 0.038290
C -3.175018 0.519048 -1.446532
C 4.334823 0.197400 0.288165
C -4.482483 -0.280555 0.478533
C 4.762834 0.726125 -0.961554
C -3.273004 -0.669341 1.120482
C 3.050394 0.559503 0.771634
C -4.408429 0.310308 -0.810749
C 5.173244 -0.705878 1.106945
C -5.812782 -0.466713 1.097278
C 7.341309 -1.858378 1.255259
C -7.018391 -1.307402 3.068852
C 7.084833 -3.313695 0.851520
C -7.611534 -2.655195 2.645298
H -1.581016 2.791301 -2.473733
H -0.368723 2.797677 -3.777365
H 0.162675 2.896526 -0.731494
H 0.325784 4.246507 -1.864048
H -1.194967 0.494733 -3.450776
H 0.530011 0.598795 -3.043948
H 2.254254 3.114043 -2.872247
H 0.108793 -0.005364 -0.877259
H 4.274893 1.971409 -2.665249
H -1.112087 -0.782755 0.997012
H 1.238790 1.692466 0.466728
H -3.154644 0.976145 -2.440531
H 5.754310 0.459670 -1.338204
H -3.322741 -1.128508 2.111710
H 2.733038 0.165148 1.743217
H -5.343502 0.603904 -1.300100
H 8.348799 -1.520128 0.962672
H 7.189115 -1.712864 2.339161
H -7.711350 -0.478780 2.839019
H -6.748264 -1.293185 4.137495
H 7.823465 -3.974565 1.342642
H 6.076212 -3.632433 1.163714
H 7.178600 -3.441965 -0.240860
H -8.525607 -2.864520 3.232215
H -7.883264 -2.640573 1.576627
H -6.892568 -3.474266 2.820852


