%chk=000249832.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249832

0 1
O -1.010985 0.190008 -1.029155
O -0.586741 -1.398271 0.527555
N -4.574141 0.127197 0.036432
C -3.113698 0.412876 0.187060
C -4.936482 -1.170855 0.700486
C -5.421873 1.258991 0.536531
C -2.425282 -0.175832 -1.051904
C -6.246439 -1.703352 0.118291
C -5.343384 2.441015 -0.430712
C -0.174899 -0.513031 -0.190872
C 1.198144 0.001575 -0.347379
C 3.601603 -0.047588 0.273774
C 2.207546 -0.504480 0.375357
C 3.913325 1.301587 0.037824
C 4.640915 -0.983036 0.427761
C 5.247868 1.707547 -0.047253
C 5.971763 -0.572092 0.333364
C 6.277544 0.772944 0.097090
H -2.920909 1.506799 0.228471
H -2.663061 -0.013789 1.110245
H -4.123852 -1.906476 0.501824
H -5.014657 -1.081728 1.805440
H -6.475440 0.900619 0.587870
H -5.146428 1.582786 1.563236
H -2.761679 0.294858 -1.992987
H -2.514691 -1.273187 -1.110712
H -7.104140 -1.081394 0.397597
H -6.208349 -1.719474 -0.979622
H -6.442682 -2.723460 0.463605
H -4.348194 2.899771 -0.441259
H -5.556137 2.118125 -1.459091
H -6.068539 3.216104 -0.163956
H 1.320139 0.796732 -1.086736
H 2.027003 -1.318510 1.093280
H 3.114722 2.034841 -0.070715
H 4.408506 -2.031233 0.613235
H 5.484771 2.755339 -0.227531
H 6.773865 -1.300448 0.445919
H 7.316671 1.090923 0.027137


%chk=000249832-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249832

0 1
O -1.041025 0.657140 -1.114800
O -0.587763 -1.340858 0.025515
N -4.592731 0.222625 0.122291
C -3.201933 0.732728 0.130487
C -4.698039 -1.151588 0.688995
C -5.588972 1.174222 0.677867
C -2.482784 0.278610 -1.155489
C -5.878240 -1.953223 0.108382
C -5.886630 2.351278 -0.270765
C -0.186528 -0.253659 -0.469327
C 1.198532 0.255574 -0.484059
C 3.633859 -0.112758 0.153338
C 2.210912 -0.470067 0.082781
C 4.167353 1.084060 -0.409659
C 4.526804 -1.004383 0.815283
C 5.541383 1.373947 -0.310084
C 5.903114 -0.713768 0.915839
C 6.416324 0.477577 0.353167
H -3.208329 1.836213 0.167569
H -2.627078 0.377029 1.016220
H -3.756124 -1.683560 0.459265
H -4.772997 -1.120758 1.805242
H -6.526652 0.614231 0.846504
H -5.269956 1.564881 1.677530
H -2.886717 0.795666 -2.038602
H -2.562617 -0.815115 -1.280480
H -6.851029 -1.478048 0.331264
H -5.781757 -2.030562 -0.988639
H -5.898317 -2.972998 0.536266
H -4.983336 2.955729 -0.472868
H -6.265997 1.973159 -1.236053
H -6.645600 3.023430 0.171755
H 1.351310 1.225790 -0.966646
H 1.923457 -1.429486 0.538489
H 3.505059 1.786298 -0.927582
H 4.129932 -1.929281 1.251508
H 5.936629 2.297019 -0.748423
H 6.573235 -1.411779 1.429257
H 7.484951 0.707084 0.428160


