%chk=000257820.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257820

0 1
O -5.516093 -2.351935 1.087784
O 5.918316 -1.550234 -1.569851
N -5.855060 -0.444191 -0.166407
N 5.268273 -1.293773 0.629631
C -0.072988 2.359539 0.368214
C -0.491598 1.498900 -0.834097
C 1.359637 2.896837 0.227884
C -1.890168 0.977419 -0.656630
C 2.388015 1.802875 0.314645
C -2.984878 1.680481 -1.181599
C 3.025611 1.327570 -0.840990
C -2.118261 -0.215943 0.046412
C 2.719075 1.240108 1.557552
C -4.500092 0.002728 -0.307454
C 4.302232 -0.245573 0.479719
C -4.284584 1.203859 -1.014416
C 3.978159 0.311565 -0.768678
C -3.410290 -0.707596 0.224728
C 3.667588 0.223355 1.649447
C -6.283731 -1.599096 0.523551
C 6.020471 -1.887391 -0.407861
C -7.774896 -1.801744 0.490830
C 6.952899 -2.969068 0.066872
H -0.775742 3.207886 0.481309
H -0.163930 1.765086 1.299021
H -0.407714 2.085965 -1.769952
H 0.223211 0.657214 -0.957318
H 1.547222 3.650758 1.020753
H 1.460602 3.452790 -0.726268
H -2.822371 2.609552 -1.726440
H 2.777885 1.753284 -1.813306
H -1.275174 -0.769983 0.460540
H 2.229369 1.598759 2.462187
H -5.118080 1.762931 -1.430696
H 4.468308 -0.047382 -1.680583
H -3.572011 -1.640688 0.775627
H 3.908792 -0.198789 2.621400
H -6.558464 0.144404 -0.615081
H 5.407435 -1.627170 1.584693
H -8.323241 -0.977493 0.964553
H -8.035295 -2.718827 1.046959
H -8.160630 -1.929598 -0.528777
H 7.703642 -2.598023 0.776321
H 7.505563 -3.384423 -0.793543
H 6.421884 -3.807346 0.536217


%chk=000257820-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257820

0 1
O -5.712025 -2.421040 1.177549
O 6.251785 -1.462915 -1.612113
N -5.942078 -0.469233 -0.110845
N 5.366565 -1.297650 0.558262
C -0.082246 2.370383 0.351621
C -0.514309 1.465952 -0.835771
C 1.371210 2.908041 0.217756
C -1.927665 0.930890 -0.668498
C 2.433387 1.818623 0.283730
C -3.046010 1.622104 -1.201225
C 3.181578 1.434948 -0.856732
C -2.178469 -0.256935 0.064764
C 2.696624 1.136705 1.501226
C -4.589457 -0.043337 -0.266370
C 4.402442 -0.256665 0.415378
C -4.357643 1.146898 -1.006582
C 4.156282 0.414393 -0.810861
C -3.482789 -0.751548 0.273375
C 3.663028 0.116192 1.571099
C -6.440261 -1.584082 0.567811
C 6.218266 -1.844308 -0.405683
C -7.965124 -1.706436 0.507928
C 7.116446 -2.960463 0.132749
H -0.781570 3.226593 0.428872
H -0.180529 1.798476 1.295471
H -0.435562 2.052006 -1.773128
H 0.203164 0.627852 -0.921009
H 1.542695 3.645155 1.027639
H 1.463023 3.460724 -0.737638
H -2.888369 2.540435 -1.780227
H 3.002675 1.947618 -1.810017
H -1.330568 -0.816322 0.479896
H 2.142598 1.412174 2.407204
H -5.205529 1.698746 -1.434727
H 4.725063 0.131778 -1.698153
H -3.659386 -1.669365 0.836654
H 3.849812 -0.391736 2.526989
H -6.639182 0.129253 -0.560960
H 5.439104 -1.696148 1.497793
H -8.458585 -0.827410 0.963047
H -8.264644 -2.606038 1.064221
H -8.321400 -1.799582 -0.534980
H 7.765687 -2.597309 0.951205
H 7.752367 -3.322356 -0.687618
H 6.518492 -3.807464 0.517802


