%chk=000254705.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254705

0 1
O 0.966799 2.402218 -0.001320
O 2.769382 -2.687297 -0.002046
N -1.638665 1.517919 -0.000711
C -0.940374 0.306840 -0.000649
C -1.884166 -0.794425 -0.000315
C 0.449656 0.103347 -0.000831
C -3.210065 -0.194948 -0.000200
C 0.889786 -1.236340 -0.000789
C -1.406698 -2.102250 -0.000174
C -3.028629 1.233527 -0.000456
C -0.005395 -2.302577 -0.000463
C 1.372806 1.249107 -0.000981
C 2.362222 -1.543337 -0.001141
C 2.837286 0.945098 -0.000427
C 3.304823 -0.381449 -0.000463
C -4.505138 -0.713054 0.000053
C -2.329363 -3.270521 0.000244
C -4.108787 2.120310 -0.000428
C 3.749259 2.005902 0.000141
C -5.584798 0.172909 0.000092
C 4.681476 -0.633169 0.000080
C -5.388606 1.565382 -0.000139
C 5.126093 1.748376 0.000721
C 5.590941 0.432040 0.000698
H -1.197752 2.433693 -0.001077
H 0.392972 -3.322174 -0.000468
H -4.672071 -1.787620 0.000173
H -2.982393 -3.262100 -0.886819
H -1.801519 -4.234592 0.001065
H -2.983099 -3.260969 0.886774
H -3.958121 3.195537 -0.000632
H 3.373692 3.034089 0.000106
H 5.036497 -1.668683 -0.000004
H -6.600536 -0.218968 0.000307
H -6.256958 2.224637 -0.000086
H 5.832182 2.579149 0.001202
H 6.662159 0.228893 0.001164


%chk=000254705-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254705

0 1
O 0.930125 2.453093 0.000028
O 2.820180 -2.746813 0.000418
N -1.642160 1.489486 -0.000035
C -0.949295 0.288645 -0.000085
C -1.891691 -0.802500 -0.000194
C 0.455373 0.095422 -0.000027
C -3.220317 -0.196474 -0.000303
C 0.915668 -1.257293 -0.000004
C -1.410413 -2.140488 -0.000187
C -3.022600 1.232730 -0.000200
C -0.006986 -2.335417 -0.000079
C 1.373162 1.245392 -0.000026
C 2.378502 -1.551761 0.000145
C 2.837472 0.959774 -0.000099
C 3.319234 -0.383140 -0.000042
C -4.544314 -0.704999 -0.000490
C -2.355438 -3.323344 -0.000274
C -4.099083 2.141918 -0.000248
C 3.756596 2.037417 -0.000257
C -5.626606 0.199732 -0.000549
C 4.714824 -0.624420 -0.000150
C -5.405414 1.605674 -0.000424
C 5.144003 1.787391 -0.000364
C 5.624249 0.452965 -0.000310
H -1.139951 2.383499 0.000095
H 0.406940 -3.349180 -0.000034
H -4.734111 -1.782200 -0.000599
H -3.013115 -3.308606 -0.890260
H -1.802688 -4.276714 0.000067
H -3.013695 -3.308287 0.889270
H -3.933902 3.224245 -0.000152
H 3.357259 3.056456 -0.000297
H 5.057202 -1.664140 -0.000097
H -6.653044 -0.182114 -0.000694
H -6.264818 2.285363 -0.000466
H 5.851421 2.623599 -0.000491
H 6.702327 0.259589 -0.000388


