%chk=000273813.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273813

0 1
O 2.499662 1.871619 -0.802814
O 3.673187 -1.453389 -0.717984
O 1.346614 2.737680 0.936576
O 3.822950 -0.086084 1.078807
N -1.521057 1.328726 0.045025
C -1.140890 -0.955901 0.062254
C -0.514080 0.352381 0.096111
C -2.574699 -0.738015 0.005307
C -2.784441 0.682905 -0.000337
C -0.358308 -2.112646 0.079184
C 0.889357 0.481276 0.145937
C 1.637970 -0.708412 0.163003
C 1.040616 -1.970291 0.129576
C -3.681675 -1.590240 -0.042245
C -1.334425 2.783254 0.096757
C -4.069501 1.239893 -0.052100
C -0.971534 -3.469648 0.043389
C -4.958763 -1.034607 -0.093502
C -5.147990 0.361151 -0.098204
C 1.553156 1.801381 0.197691
C 3.134096 -0.657648 0.268363
C 3.367508 3.037896 -0.800258
C 5.123954 -1.519883 -0.774413
H 1.673703 -2.859131 0.129402
H -3.548812 -2.669528 -0.038668
H -0.769366 3.078491 1.010086
H -0.765489 3.138498 -0.781687
H -2.304023 3.307093 0.114079
H -4.218396 2.315242 -0.055324
H -1.579620 -3.606862 -0.864736
H -0.226666 -4.277306 0.054957
H -1.632834 -3.629361 0.909678
H -5.829621 -1.686559 -0.130197
H -6.162391 0.758282 -0.138444
H 4.132111 2.889537 -0.029600
H 2.790598 3.948244 -0.607974
H 3.792372 3.024563 -1.808791
H 5.531674 -1.748668 0.215730
H 5.507451 -0.562922 -1.141106
H 5.296804 -2.330710 -1.489628


%chk=000273813-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273813

0 1
O 2.120678 2.229905 -1.042007
O 3.788998 -1.903775 -0.286336
O 1.654011 2.459326 1.231913
O 3.851618 0.356574 0.251330
N -1.467269 1.316110 0.083864
C -1.124014 -0.974062 -0.037330
C -0.477106 0.315728 0.032003
C -2.557873 -0.729750 -0.000958
C -2.731338 0.697559 0.080252
C -0.347964 -2.160880 -0.132563
C 0.932075 0.448021 0.025129
C 1.693167 -0.753531 -0.069251
C 1.053019 -2.023286 -0.151014
C -3.704811 -1.564044 -0.028346
C -1.246978 2.766380 0.103584
C -4.012256 1.289545 0.140478
C -0.990819 -3.530510 -0.208268
C -4.984912 -0.977515 0.026952
C -5.133907 0.435044 0.111551
C 1.611009 1.784810 0.177309
C 3.178981 -0.673366 -0.015515
C 3.005823 3.416654 -0.957332
C 5.268027 -1.901538 -0.223989
H 1.686857 -2.911206 -0.214601
H -3.607259 -2.651307 -0.089691
H -0.861892 3.106015 1.080379
H -0.523652 3.052970 -0.679308
H -2.198027 3.277022 -0.111135
H -4.147401 2.372985 0.216429
H -1.649451 -3.618082 -1.093266
H -0.227877 -4.323712 -0.274959
H -1.613613 -3.732929 0.683776
H -5.876400 -1.613228 0.008320
H -6.139038 0.868779 0.158976
H 3.903690 3.145480 -0.377556
H 2.486669 4.257778 -0.467255
H 3.259460 3.654993 -1.999792
H 5.608986 -1.607188 0.782980
H 5.680755 -1.195925 -0.964582
H 5.559236 -2.935541 -0.456272


