%chk=000192252.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192252

1 1
O 4.521909 0.712144 1.501733
N 3.890667 1.450163 -0.622796
C 2.423223 1.892777 -0.688925
C 1.884278 2.388362 0.656411
C 0.385445 2.708888 0.553475
C -0.491767 1.455783 0.442405
C -1.980698 1.827083 0.384393
C -2.866357 0.578664 0.275028
C 4.772328 2.628352 -0.257916
C 4.320092 0.936309 -1.980597
C -4.353324 0.954886 0.214242
C 4.070362 0.309108 0.477707
C -5.242776 -0.291106 0.106627
C -6.728992 0.087023 0.044434
C -7.619946 -1.157688 -0.062501
C 3.704183 -1.050717 0.063838
C -9.106850 -0.779869 -0.124836
C 2.443643 -1.371244 -0.469993
C 4.647712 -2.067403 0.308185
C -9.998567 -2.014442 -0.230929
C 2.137628 -2.696483 -0.772737
C 4.334421 -3.390634 -0.008598
C 3.082718 -3.707365 -0.546681
H 1.808441 1.026399 -1.046990
H 2.315091 2.691121 -1.460035
H 2.422458 3.302252 0.984990
H 2.044813 1.643176 1.462586
H 0.189195 3.390161 -0.298103
H 0.085278 3.286567 1.455646
H -0.313224 0.789117 1.309645
H -0.224160 0.872140 -0.457830
H -2.263385 2.405257 1.286972
H -2.174680 2.500163 -0.473485
H -2.593845 -0.005779 -0.624171
H -2.688119 -0.090209 1.139602
H 4.593880 3.493566 -0.919715
H 5.844239 2.365385 -0.319578
H 4.588076 2.956727 0.786635
H 4.271431 1.726305 -2.753464
H 5.362616 0.566991 -1.957257
H 3.684421 0.098872 -2.324868
H -4.541370 1.624615 -0.647309
H -4.634048 1.537360 1.113695
H -4.968659 -0.877039 -0.791556
H -5.063990 -0.959907 0.970815
H -7.008353 0.671379 0.942698
H -6.913888 0.755683 -0.818483
H -7.346468 -1.744853 -0.960008
H -7.441582 -1.827404 0.800734
H -9.385603 -0.194983 0.773785
H -9.290886 -0.111591 -0.988889
H 1.692784 -0.590199 -0.630234
H 5.618923 -1.828390 0.750699
H -9.779121 -2.597853 -1.132234
H -11.057840 -1.734593 -0.274018
H -9.873201 -2.680896 0.630053
H 1.155202 -2.953030 -1.179255
H 5.067083 -4.182666 0.176217
H 2.836756 -4.747532 -0.785558


%chk=000192252-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192252

1 1
O 5.338507 1.158989 0.806947
N 3.808811 1.525510 -1.027215
C 2.286313 1.669182 -0.730550
C 1.943791 1.778597 0.764140
C 0.446594 2.138798 0.967129
C -0.552089 1.094972 0.412353
C -2.018954 1.435501 0.762425
C -3.035052 0.421319 0.190608
C 4.454910 2.909117 -0.924315
C 4.045136 1.002758 -2.443273
C -4.502378 0.788744 0.508125
C 4.547940 0.564432 0.062318
C -5.522725 -0.219041 -0.067553
C -6.990575 0.166004 0.225468
C -8.013607 -0.838374 -0.351463
C 4.290912 -0.889341 0.061476
C -9.481670 -0.443994 -0.069649
C 3.185020 -1.559460 -0.542246
C 5.254250 -1.660427 0.787361
C -10.497633 -1.451803 -0.648963
C 3.055028 -2.955635 -0.425750
C 5.122989 -3.056111 0.887525
C 4.023932 -3.709431 0.279934
H 1.780051 0.811201 -1.195770
H 1.967532 2.579773 -1.270413
H 2.566767 2.554289 1.248921
H 2.156348 0.820203 1.275981
H 0.238036 3.130199 0.515214
H 0.275268 2.254817 2.054186
H -0.302896 0.091907 0.819221
H -0.466846 1.021785 -0.693017
H -2.129273 1.484693 1.865175
H -2.260340 2.448993 0.380005
H -2.908841 0.354075 -0.910826
H -2.815567 -0.589658 0.593310
H 4.012397 3.540444 -1.710186
H 5.540662 2.820412 -1.066835
H 4.262720 3.336641 0.067823
H 3.533360 1.672884 -3.152381
H 5.126820 1.002673 -2.648749
H 3.655141 -0.017245 -2.545786
H -4.721492 1.799787 0.105812
H -4.635246 0.856418 1.607873
H -5.379797 -0.299921 -1.165764
H -5.319156 -1.228122 0.348140
H -7.137168 0.247516 1.322814
H -7.194595 1.174785 -0.190708
H -7.864673 -0.926908 -1.448257
H -7.819347 -1.846639 0.070847
H -9.631404 -0.354833 1.025755
H -9.675453 0.562954 -0.492466
H 2.397946 -1.016204 -1.069887
H 6.095822 -1.145836 1.261262
H -10.392698 -1.535052 -1.747256
H -11.537881 -1.147805 -0.432224
H -10.344820 -2.460354 -0.220437
H 2.196777 -3.459261 -0.880606
H 5.871133 -3.633878 1.438165
H 3.918858 -4.796135 0.359933


