%chk=000257446.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257446

0 1
O -0.308887 2.016398 1.524003
N -1.547457 -0.035649 2.092696
C 4.155207 -0.889658 -0.508371
C 2.949099 -0.148592 0.073235
C 0.807689 -0.141777 1.243158
C -0.306224 -0.864576 1.953357
C 1.916982 -0.826790 0.734868
C 0.748865 1.253086 1.075746
C 4.332851 -2.285244 0.121849
C 3.926670 -1.043058 -2.025701
C 5.446736 -0.085838 -0.251191
C 2.843713 1.245113 -0.098425
C -1.226734 1.348226 2.457724
C 1.755708 1.957276 0.398360
C -2.475933 -0.198054 0.982329
C -3.359630 -1.288898 1.060839
C -2.543193 0.686701 -0.105982
C -4.305948 -1.485111 0.055467
C -3.497828 0.485663 -1.102779
C -4.384425 -0.600918 -1.032980
C -5.411970 -0.804850 -2.098668
H -0.556963 -1.814926 1.430930
H 0.018443 -1.142676 2.984325
H 1.962252 -1.909412 0.856580
H 3.480309 -2.939643 -0.086620
H 4.452324 -2.219547 1.208460
H 5.223225 -2.785001 -0.274550
H 3.011013 -1.607092 -2.233572
H 4.757590 -1.570080 -2.503944
H 3.825317 -0.070219 -2.517635
H 5.579727 0.115632 0.817195
H 5.440774 0.877878 -0.770639
H 6.329846 -0.631965 -0.597663
H 3.628618 1.785341 -0.630113
H -2.109100 2.018167 2.418599
H -0.733338 1.371272 3.450775
H 1.670991 3.033693 0.273867
H -3.308430 -1.969677 1.909682
H -1.846646 1.526022 -0.174432
H -4.990583 -2.328772 0.120126
H -3.549352 1.176623 -1.942544
H -6.332635 -0.251415 -1.860814
H -5.689185 -1.860733 -2.215344
H -5.067488 -0.454521 -3.080804


%chk=000257446-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257446

0 1
O -0.253725 2.186452 1.163758
N -1.499542 0.154909 1.767904
C 4.376132 -0.964894 -0.405474
C 3.122467 -0.170461 0.031192
C 0.883716 -0.027307 1.096724
C -0.298587 -0.722275 1.781666
C 2.030249 -0.762059 0.707632
C 0.836210 1.362078 0.803390
C 4.300071 -2.459968 -0.001423
C 4.524739 -0.886926 -1.955091
C 5.641130 -0.345879 0.262996
C 3.028110 1.220707 -0.261438
C -1.169298 1.498656 2.148875
C 1.906857 1.979027 0.115669
C -2.569764 -0.099411 0.852216
C -3.107964 -1.410251 0.739721
C -3.150978 0.936207 0.070165
C -4.189496 -1.670881 -0.125307
C -4.248613 0.662959 -0.773233
C -4.792596 -0.640402 -0.892099
C -5.987374 -0.920398 -1.787810
H -0.534047 -1.660132 1.252816
H -0.044019 -0.990421 2.828083
H 2.050578 -1.833867 0.936634
H 3.439327 -2.968931 -0.473935
H 4.221368 -2.584725 1.094675
H 5.217883 -2.979942 -0.332213
H 3.643861 -1.327618 -2.456881
H 5.425434 -1.440079 -2.282665
H 4.622919 0.157065 -2.302607
H 5.568419 -0.399114 1.364804
H 5.772483 0.715030 -0.015648
H 6.549002 -0.894294 -0.052606
H 3.845068 1.724467 -0.790884
H -2.055366 2.144814 2.204039
H -0.631351 1.485179 3.116397
H 1.840936 3.048995 -0.105435
H -2.698908 -2.221339 1.352932
H -2.718898 1.942027 0.083455
H -4.584471 -2.692390 -0.191507
H -4.674513 1.478906 -1.370680
H -6.941180 -0.786914 -1.240173
H -5.972666 -1.956245 -2.171060
H -6.011597 -0.237958 -2.656175


