%chk=000220548.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220548

0 1
O -5.799786 0.772259 -1.274861
O -5.688245 -1.326751 -1.781790
N 2.312861 -0.223138 1.084063
N -5.237737 -0.311919 -1.272934
C 3.427231 0.436641 0.338371
C 4.593974 0.633996 1.331825
C 3.901511 -0.362375 -0.899377
C 5.770707 1.340289 0.647953
C 5.082005 0.344257 -1.577803
C 6.239169 0.570617 -0.594778
C 1.026180 -0.257135 0.329339
C -0.094422 -0.661447 1.309284
C -1.434783 -0.573664 0.641361
C -2.126622 0.650827 0.608489
C -2.001620 -1.710554 0.037986
C -3.368514 0.742373 -0.014044
C -3.243401 -1.631152 -0.587599
C -3.922944 -0.402154 -0.611359
H 3.065385 1.443109 0.003285
H 4.922918 -0.339829 1.739497
H 4.243340 1.223213 2.201207
H 3.072914 -0.481621 -1.619746
H 4.200496 -1.384176 -0.601222
H 6.608023 1.447970 1.362878
H 5.478797 2.369874 0.364355
H 4.749590 1.314665 -1.994580
H 5.431797 -0.254176 -2.439917
H 7.056331 1.122740 -1.095038
H 6.668484 -0.403431 -0.291334
H 2.579599 -1.170996 1.367625
H 0.819963 0.759102 -0.075526
H 1.038845 -0.951269 -0.538362
H -0.050792 -0.000795 2.204518
H 0.090205 -1.680706 1.704677
H -1.687774 1.534193 1.074316
H -1.468481 -2.660941 0.059183
H -3.917283 1.690220 -0.044389
H -3.695621 -2.510417 -1.059555


%chk=000220548-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220548

0 1
O -5.902067 0.755402 -1.366582
O -5.756229 -1.477513 -1.809976
N 2.327999 -0.257589 1.035752
N -5.290427 -0.381704 -1.306773
C 3.464369 0.400931 0.345810
C 4.644929 0.550146 1.334207
C 3.939817 -0.309247 -0.956925
C 5.845600 1.282107 0.689784
C 5.133070 0.431682 -1.608386
C 6.307497 0.584147 -0.612326
C 1.031723 -0.285510 0.338720
C -0.118605 -0.566420 1.351900
C -1.482551 -0.529554 0.690870
C -2.205701 0.690679 0.593505
C -2.045358 -1.698988 0.111133
C -3.451758 0.751955 -0.058174
C -3.290114 -1.662996 -0.545629
C -3.978005 -0.431777 -0.621929
H 3.120867 1.421439 0.069318
H 4.967222 -0.461923 1.663102
H 4.292430 1.085882 2.234987
H 3.099314 -0.387344 -1.674511
H 4.246140 -1.346460 -0.700139
H 6.683049 1.340806 1.411609
H 5.552053 2.326873 0.457217
H 4.801560 1.438522 -1.938156
H 5.465079 -0.106548 -2.517321
H 7.134932 1.153038 -1.078926
H 6.707576 -0.421335 -0.365288
H 2.593440 -1.179377 1.410710
H 0.871595 0.709748 -0.120187
H 0.966322 -1.031140 -0.490580
H -0.041941 0.189511 2.153480
H 0.055771 -1.556753 1.816373
H -1.786166 1.598996 1.041057
H -1.503379 -2.648856 0.185133
H -4.020639 1.682259 -0.135292
H -3.737113 -2.555386 -0.991570


