%chk=000236310.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236310

0 1
O -1.521902 -1.764858 -0.500952
O -5.295916 0.870985 -0.508279
N -3.586584 -0.712042 -0.515718
C -0.725147 0.996062 0.762857
C -1.663023 0.713106 -0.455983
C -2.942625 1.572018 -0.492211
C -2.152239 -0.738819 -0.475012
C 0.541732 0.178545 0.621350
C -1.443005 0.600507 2.069349
C -0.383456 2.497356 0.819968
C -4.118123 0.609539 -0.498947
C 1.465849 0.228316 -0.350484
C 2.664321 -0.689428 -0.300831
C 3.969124 0.069097 0.037810
C -4.429109 -1.934899 -0.463354
C 5.178296 -0.865962 -0.177389
C 1.420761 1.143545 -1.534886
C 3.925121 0.602871 1.474040
C 6.511498 -0.105758 -0.165566
C -4.805900 -2.291277 0.971308
C 7.694768 -1.037284 -0.420069
H -1.063969 0.884078 -1.392572
H -3.020176 2.255403 0.377259
H -2.976788 2.227324 -1.382229
H 0.680853 -0.540300 1.433950
H -1.650825 -0.475534 2.110419
H -2.396456 1.122935 2.191000
H -0.828070 0.841446 2.944177
H 0.415503 2.678881 1.549593
H -1.242608 3.103925 1.122867
H -0.031398 2.879441 -0.142252
H 2.507164 -1.503784 0.435162
H 2.768152 -1.207319 -1.275975
H 4.063420 0.937105 -0.660229
H -3.856861 -2.766976 -0.936954
H -5.344125 -1.751872 -1.073280
H 5.070729 -1.400149 -1.141127
H 5.188664 -1.654317 0.598735
H 2.025105 0.773053 -2.373106
H 0.392974 1.273057 -1.914270
H 1.808692 2.137824 -1.272333
H 4.813853 1.198516 1.706424
H 3.874046 -0.209466 2.206933
H 3.045822 1.238304 1.632415
H 6.495520 0.695303 -0.930120
H 6.643548 0.406948 0.807770
H -5.423170 -3.197036 0.999167
H -5.381117 -1.487864 1.449800
H -3.919654 -2.478428 1.590135
H 8.642201 -0.487239 -0.405090
H 7.617861 -1.531832 -1.394944
H 7.759971 -1.823545 0.340674


%chk=000236310-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236310

0 1
O -1.620514 -1.833875 -0.093001
O -5.461143 0.740121 -0.812450
N -3.695884 -0.793573 -0.481082
C -0.770474 1.039348 0.811150
C -1.806004 0.674829 -0.323177
C -3.117587 1.506598 -0.365324
C -2.293303 -0.788888 -0.267170
C 0.535428 0.245456 0.616074
C -1.354242 0.660732 2.201883
C -0.507739 2.575368 0.803601
C -4.248732 0.501726 -0.590137
C 1.514214 0.361182 -0.328719
C 2.728329 -0.561888 -0.268209
C 4.096833 0.162821 -0.063334
C -4.499379 -2.028602 -0.555307
C 5.251979 -0.867080 -0.185549
C 1.529896 1.341221 -1.494912
C 4.127185 0.917572 1.285997
C 6.674703 -0.262847 -0.150634
C -5.035911 -2.455534 0.826123
C 7.772462 -1.325615 -0.377886
H -1.280856 0.779702 -1.292501
H -3.315281 2.030144 0.587667
H -3.133891 2.270914 -1.159299
H 0.681661 -0.548465 1.362673
H -1.512445 -0.429420 2.284414
H -2.316067 1.169969 2.400820
H -0.649918 0.960952 2.998979
H 0.296263 2.814494 1.522598
H -1.409579 3.138121 1.108550
H -0.194321 2.949266 -0.185470
H 2.597388 -1.299725 0.548007
H 2.788333 -1.141010 -1.215350
H 4.222753 0.904882 -0.881520
H -3.848809 -2.814387 -0.976799
H -5.334010 -1.831402 -1.250465
H 5.130305 -1.426689 -1.137532
H 5.153300 -1.616664 0.628849
H 1.967548 0.858322 -2.389338
H 0.530124 1.713129 -1.771061
H 2.159313 2.225996 -1.272002
H 5.043804 1.524220 1.395996
H 4.089330 0.201145 2.130171
H 3.257144 1.592471 1.383048
H 6.755138 0.525500 -0.927449
H 6.848514 0.237341 0.821889
H -5.630915 -3.381033 0.726720
H -5.686401 -1.673204 1.253674
H -4.204998 -2.654197 1.524657
H 8.783264 -0.878708 -0.346484
H 7.650147 -1.818627 -1.360903
H 7.726348 -2.112608 0.398524


