%chk=000252604.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252604

0 1
O -3.993436 1.930761 0.024100
O 3.993606 1.925964 -0.033029
N -2.418458 0.237546 0.067088
N 2.416629 0.234424 -0.068085
C -1.212694 1.007029 0.029015
C 1.211784 1.005477 -0.032781
C -0.000886 0.289257 -0.000700
C -1.216679 2.411495 0.025612
C 1.217451 2.409933 -0.034128
C 0.000794 3.092597 -0.005421
C -4.774706 -0.337564 0.128652
C 4.772168 -0.343694 -0.128481
C -3.738371 0.746810 0.071835
C 3.737128 0.742117 -0.075627
C -5.646948 -0.497249 -0.955365
C -4.895405 -1.145488 1.266258
C 5.644615 -0.500134 0.955832
C 4.891485 -1.156256 -1.262943
C -6.636695 -1.483181 -0.903864
C -5.890385 -2.125896 1.312572
C 6.633187 -1.487442 0.907859
C 5.885278 -2.138014 -1.305746
C -6.757669 -2.296544 0.227764
C 6.752773 -2.305404 -0.220584
H -0.001534 -0.794859 0.001046
H -2.159172 2.966550 0.045887
H 2.160612 2.963784 -0.056343
H -2.297929 -0.779006 0.075280
H 2.294905 -0.782013 -0.071998
H 0.001450 4.184736 -0.007273
H -5.558338 0.150656 -1.828921
H -4.227257 -1.002908 2.115683
H 5.557116 0.151311 1.826863
H 4.223201 -1.016208 -2.112680
H -7.317702 -1.612485 -1.744377
H -5.992899 -2.754209 2.196411
H 7.314362 -1.614201 1.748623
H 5.986731 -2.769940 -2.187130
H -7.532534 -3.061965 0.266702
H 7.526719 -3.071888 -0.256806


%chk=000252604-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000252604

0 1
O -4.090359 1.941810 -0.213894
O 4.090089 1.937481 0.206477
N -2.421762 0.295989 -0.029042
N 2.419719 0.292861 0.027760
C -1.233250 1.080236 -0.020768
C 1.232242 1.078606 0.016323
C -0.000985 0.379825 -0.000843
C -1.236478 2.501024 -0.027438
C 1.237450 2.499392 0.017390
C 0.000959 3.177110 -0.006352
C -4.778747 -0.377619 -0.016344
C 4.776053 -0.383402 0.017402
C -3.750720 0.725165 -0.088167
C 3.749166 0.720698 0.085722
C -6.056860 -0.109059 -0.569927
C -4.542628 -1.634326 0.602928
C 6.054464 -0.114388 0.570070
C 4.538666 -1.641809 -0.597935
C -7.071229 -1.087463 -0.533646
C -5.561146 -2.611785 0.643724
C 7.067837 -1.093935 0.536869
C 5.556186 -2.620431 -0.635656
C -6.824998 -2.344312 0.068613
C 6.820315 -2.352428 -0.061411
H -0.001748 -0.720132 0.001341
H -2.184919 3.038123 -0.054118
H 2.186641 3.035277 0.041997
H -2.278536 -0.716006 -0.035267
H 2.275242 -0.718921 0.037655
H 0.001726 4.272671 -0.008501
H -6.230034 0.876278 -1.014551
H -3.588087 -1.847014 1.101127
H 6.228649 0.872171 1.011576
H 3.583931 -1.855064 -1.095514
H -8.052391 -0.871803 -0.970196
H -5.374305 -3.573270 1.134336
H 8.049225 -0.877900 0.972723
H 5.368375 -3.583265 -1.123245
H -7.613970 -3.103735 0.100531
H 7.608513 -3.112750 -0.090949


