%chk=000258754.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258754

0 1
O 0.440470 0.136381 -0.038380
O 1.459730 1.787477 1.114608
N -4.251957 -1.062302 -0.064227
C -3.301455 0.100710 0.100046
C -1.839525 -0.398529 0.120404
C -3.496363 1.055214 -1.103360
C -0.873299 0.786470 0.154856
C -2.526572 2.240045 -1.039587
C -1.069054 1.769514 -0.999897
C -5.671149 -0.605926 0.068375
C -3.998903 -2.148670 0.930586
C 1.548733 0.750975 0.491781
C 2.775376 -0.027335 0.192690
C 3.997562 0.441634 0.701432
C 2.730943 -1.199252 -0.576633
C 5.172521 -0.265475 0.438637
C 3.910707 -1.901247 -0.835593
C 5.128732 -1.435120 -0.328778
H -3.500905 0.661172 1.049934
H -1.647139 -1.054911 0.988929
H -1.640541 -1.022621 -0.776015
H -4.539271 1.424253 -1.136244
H -3.349959 0.487935 -2.044623
H -0.860191 1.299671 1.140946
H -2.681239 2.896847 -1.917276
H -2.745659 2.865660 -0.152187
H -0.791810 1.283410 -1.956132
H -0.381606 2.630090 -0.885517
H -5.881238 0.167482 -0.689119
H -5.936236 -0.203345 1.056605
H -6.337840 -1.455306 -0.151530
H -4.777966 -2.921846 0.832268
H -3.973028 -1.819688 1.979283
H -3.042381 -2.640108 0.689493
H 4.017114 1.357373 1.298760
H 1.772910 -1.552867 -0.966988
H 6.122423 0.094424 0.831182
H 3.880926 -2.811420 -1.432584
H 6.047640 -1.984968 -0.532547


%chk=000258754-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258754

0 1
O 0.471668 0.028056 -0.155177
O 1.481114 1.758084 1.048149
N -4.330878 -1.042655 -0.021394
C -3.347859 0.080256 0.098696
C -1.894877 -0.455344 -0.018003
C -3.592896 1.157476 -0.990620
C -0.867482 0.683843 0.020677
C -2.531223 2.282533 -0.953918
C -1.095889 1.722915 -1.085418
C -5.739542 -0.587505 0.043638
C -4.100360 -2.131162 0.957100
C 1.572380 0.679386 0.407145
C 2.845477 -0.062175 0.161437
C 4.044296 0.475083 0.698384
C 2.882290 -1.270077 -0.582884
C 5.270043 -0.190933 0.494391
C 4.111565 -1.932455 -0.785483
C 5.305968 -1.395851 -0.247960
H -3.455168 0.577425 1.104199
H -1.660733 -1.156163 0.801783
H -1.800955 -1.008321 -0.972614
H -4.591255 1.613516 -0.866143
H -3.579973 0.653825 -1.978075
H -0.861890 1.188121 1.006999
H -2.727298 3.006037 -1.767168
H -2.619658 2.845854 -0.002031
H -0.969196 1.233564 -2.070863
H -0.348964 2.532609 -1.004790
H -5.981863 0.064009 -0.811088
H -5.983995 -0.033832 0.986739
H -6.403293 -1.468049 -0.014976
H -4.895216 -2.888939 0.841955
H -4.110086 -1.780803 2.021354
H -3.138590 -2.634401 0.768396
H 3.989690 1.408326 1.268720
H 1.951480 -1.673346 -0.990970
H 6.194100 0.224640 0.910612
H 4.140644 -2.864511 -1.360386
H 6.258923 -1.913237 -0.406816


