%chk=000245399.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245399

0 1
O -1.583597 -1.769395 0.374463
O 5.701664 -0.691713 -0.086385
O 4.850998 1.400006 -0.209623
N -2.792406 0.140328 0.066308
C -2.870350 1.628028 -0.062515
C -4.085074 -0.626810 -0.023777
C -1.593442 -0.547455 0.296418
C -0.315170 0.258161 0.474563
C 0.878258 -0.513117 -0.100090
C -3.599334 2.233426 1.143412
C -3.538881 2.025811 -1.384394
C -4.354339 -1.373040 1.287551
C -4.052014 -1.584912 -1.219150
C 2.196995 0.210808 0.186649
C 3.387332 -0.570669 -0.379882
C 4.662274 0.207259 -0.221070
C 7.038358 -0.139718 0.038974
H -1.815207 2.031714 -0.078218
H -4.905846 0.123113 -0.185051
H -0.380985 1.265562 0.010532
H -0.172472 0.433589 1.562057
H 0.741738 -0.654803 -1.190304
H 0.891074 -1.538845 0.330413
H -3.587978 3.327890 1.101939
H -4.648865 1.920813 1.193725
H -3.131584 1.929442 2.087342
H -3.047743 1.545880 -2.239857
H -3.490808 3.109530 -1.536630
H -4.596800 1.739293 -1.420407
H -4.354328 -0.698099 2.148113
H -3.579371 -2.136271 1.471067
H -5.317531 -1.890217 1.257891
H -5.001656 -2.116122 -1.327885
H -3.843167 -1.060133 -2.155738
H -3.263502 -2.345492 -1.089363
H 2.182284 1.232804 -0.247264
H 2.327724 0.352337 1.278343
H 3.476394 -1.567007 0.107357
H 3.238186 -0.789383 -1.460632
H 7.628481 -1.004287 0.359911
H 7.358505 0.234361 -0.937860
H 7.048881 0.663030 0.783966


%chk=000245399-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245399

0 1
O -1.571206 -1.809882 -0.031079
O 5.879755 -0.742308 0.110875
O 4.907864 1.345784 -0.232092
N -2.840132 0.143532 -0.000558
C -2.948162 1.634228 0.013906
C -4.124703 -0.638026 -0.002721
C -1.624265 -0.535319 -0.014012
C -0.321864 0.293179 -0.006497
C 0.930650 -0.605968 -0.011844
C -3.630454 2.147952 1.306583
C -3.646731 2.171791 -1.260266
C -4.282384 -1.500902 1.272069
C -4.299428 -1.466753 -1.297711
C 2.232234 0.223297 -0.010428
C 3.483624 -0.675704 -0.008136
C 4.781885 0.112035 -0.058531
C 7.211782 -0.092965 0.057527
H -1.919612 2.028200 0.010787
H -4.925236 0.125270 0.012994
H -0.295234 0.964444 -0.889573
H -0.297340 0.951850 0.886017
H 0.896392 -1.269024 -0.896643
H 0.898070 -1.277676 0.866454
H -3.622622 3.253151 1.324038
H -4.683994 1.820681 1.373873
H -3.098812 1.781555 2.202586
H -3.127060 1.821419 -2.169570
H -3.637755 3.277117 -1.257629
H -4.701442 1.846869 -1.319766
H -4.206109 -0.878351 2.182044
H -3.503227 -2.278175 1.307181
H -5.274278 -1.990168 1.270079
H -5.293087 -1.952449 -1.297761
H -4.230605 -0.821027 -2.191933
H -3.523717 -2.245674 -1.362003
H 2.265010 0.889026 -0.894481
H 2.259579 0.889420 0.874407
H 3.506832 -1.329433 0.884516
H 3.470418 -1.362675 -0.878055
H 7.929219 -0.911051 0.211787
H 7.363814 0.390092 -0.922576
H 7.299031 0.668338 0.851043


