%chk=000258729.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258729

0 1
O 6.311346 -0.554150 -1.106575
O 0.238629 -0.037941 2.419426
N 3.696278 -0.539215 0.049937
C 2.635797 -0.067056 0.997977
C 4.148907 0.568320 -0.855444
C 4.872148 -1.090014 0.802970
C 1.288447 -0.045514 0.261269
C 5.197569 0.008420 -1.829755
C 5.904046 -1.608952 -0.211092
C -1.214970 0.150467 0.538243
C 0.120297 0.017273 1.217671
C -1.924109 -1.008328 0.175698
C -1.728633 1.432772 0.274160
C -3.177635 -0.874620 -0.507093
C -2.982358 1.555620 -0.409506
C -3.682238 0.402064 -0.790722
C -1.438086 -2.339175 0.466108
C -1.039303 2.641395 0.668405
C -3.896652 -2.068414 -0.890910
C -3.499159 2.875429 -0.692349
C -2.147745 -3.439711 0.090004
C -1.562032 3.867697 0.386368
C -3.399152 -3.303762 -0.605473
C -2.813464 3.989032 -0.311383
H 2.845710 0.929183 1.441952
H 2.566079 -0.776581 1.855972
H 4.574854 1.432923 -0.301932
H 3.269903 0.939835 -1.422794
H 4.518395 -1.928910 1.439862
H 5.347142 -0.341527 1.473066
H 1.239337 0.796627 -0.457921
H 1.196909 -0.955705 -0.377003
H 4.770025 -0.766793 -2.489912
H 5.679000 0.801486 -2.427595
H 6.856167 -1.892875 0.269742
H 5.505713 -2.450210 -0.805439
H -4.634740 0.499584 -1.313103
H -0.497671 -2.442479 1.008439
H -0.100410 2.548906 1.214583
H -4.845842 -1.947443 -1.411869
H -4.451840 2.949399 -1.215854
H -1.788129 -4.444786 0.309708
H -1.049954 4.781759 0.686007
H -3.931928 -4.209998 -0.889665
H -3.193448 4.988266 -0.518577


%chk=000258729-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258729

0 1
O 6.486954 0.411316 -0.796663
O 0.174260 -1.440848 2.001605
N 3.841144 -0.367939 0.134756
C 2.598208 -0.264082 0.933807
C 4.026358 0.764664 -0.809960
C 5.043480 -0.511336 0.999484
C 1.332428 -0.491600 0.083041
C 5.296170 0.551457 -1.650653
C 6.294080 -0.716904 0.130441
C -1.249758 -0.319746 0.386659
C 0.083704 -0.766978 0.934150
C -2.267320 -1.298900 0.136274
C -1.479588 1.063164 0.095998
C -3.518583 -0.877243 -0.490240
C -2.737755 1.466377 -0.523251
C -3.715109 0.485828 -0.811282
C -2.106822 -2.700853 0.441356
C -0.538955 2.103236 0.440949
C -4.534167 -1.859030 -0.777511
C -2.970332 2.858385 -0.814982
C -3.111504 -3.618720 0.150013
C -0.799737 3.439316 0.150937
C -4.340405 -3.198806 -0.465438
C -2.023870 3.824811 -0.495631
H 2.524169 0.723618 1.461521
H 2.620865 -1.044000 1.715912
H 4.107288 1.738783 -0.261972
H 3.155316 0.826491 -1.487657
H 4.905017 -1.387429 1.660789
H 5.195308 0.390140 1.645788
H 1.140020 0.325843 -0.630760
H 1.499109 -1.407606 -0.523748
H 5.175817 -0.358796 -2.277100
H 5.496847 1.422654 -2.295978
H 7.207195 -0.752101 0.747412
H 6.194442 -1.661991 -0.445812
H -4.656089 0.792595 -1.285548
H -1.190608 -3.037996 0.932165
H 0.380871 1.842386 0.975010
H -5.465875 -1.523857 -1.248483
H -3.919249 3.141976 -1.285517
H -2.969272 -4.676359 0.397733
H -0.073225 4.210363 0.430002
H -5.117507 -3.938930 -0.684491
H -2.210121 4.880942 -0.717526


