%chk=000257443.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257443

0 1
O 3.600100 -1.952644 0.145269
O -1.859044 -3.494540 0.496119
N 0.220080 -0.485983 1.621989
C -1.059577 -1.239491 1.858041
C 0.989035 -1.070909 0.472683
C -1.984874 -1.148270 0.671143
C 2.092506 -0.131230 0.059412
C -2.506470 0.100734 0.196345
C -3.417952 0.109151 -0.896796
C 1.047088 -0.498025 2.866872
C 3.409970 -0.606118 -0.114861
C -2.381774 -2.307440 0.020763
C 1.841735 1.219354 -0.187528
C 4.458291 0.235716 -0.527945
C 2.872283 2.082556 -0.598702
C -2.142418 1.356181 0.787277
C -3.793629 -1.119921 -1.522894
C 4.170688 1.586854 -0.767020
C -3.287319 -2.314482 -1.079639
C -3.951820 1.353937 -1.362513
C -2.668771 2.532657 0.320398
C 5.845113 -0.290010 -0.708639
C 2.567668 3.524464 -0.851697
C -3.590050 2.535040 -0.768348
H -1.562501 -0.780456 2.741370
H -0.883998 -2.310828 2.119762
H 0.292204 -1.198577 -0.390085
H 1.399856 -2.083685 0.694355
H 1.967027 0.083868 2.683812
H 1.344459 -1.498268 3.214586
H 0.496152 0.007219 3.674026
H 0.827053 1.599457 -0.045873
H -1.417608 1.355961 1.606177
H -4.490495 -1.090062 -2.360983
H 4.969812 2.252040 -1.087048
H -3.560592 -3.256051 -1.546165
H -4.650018 1.340079 -2.197897
H -2.390360 3.484282 0.770601
H 6.555878 0.231197 -0.050873
H 5.921554 -1.365291 -0.484688
H 6.191004 -0.147662 -1.742994
H 1.775669 3.636259 -1.606012
H 2.216130 4.019900 0.064575
H 3.438284 4.086301 -1.211022
H -3.992002 3.484904 -1.114078
H 4.550230 -2.208164 -0.004375
H -2.185797 -4.269902 -0.019098


%chk=000257443-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257443

0 1
O 3.634046 -2.064216 -0.081380
O -1.761072 -3.541288 0.464742
N 0.210186 -0.473520 1.724648
C -1.093085 -1.184420 1.889247
C 1.079107 -1.104682 0.696552
C -1.969486 -1.144217 0.646587
C 2.167695 -0.163991 0.193938
C -2.525744 0.094572 0.155319
C -3.413565 0.090095 -0.992492
C 0.904470 -0.325033 3.021619
C 3.432728 -0.666329 -0.202602
C -2.306642 -2.332742 -0.021233
C 1.933186 1.223005 0.067352
C 4.452019 0.185974 -0.706402
C 2.918757 2.109716 -0.431751
C -2.232031 1.356728 0.777217
C -3.718170 -1.154634 -1.632485
C 4.171384 1.569479 -0.810993
C -3.175619 -2.345981 -1.159277
C -3.974364 1.323387 -1.461756
C -2.798339 2.541878 0.301004
C 5.798428 -0.383959 -1.121561
C 2.632809 3.597106 -0.561752
C -3.678516 2.530857 -0.827341
H -1.624373 -0.680141 2.721192
H -0.944543 -2.245208 2.191778
H 0.430000 -1.389693 -0.154150
H 1.543772 -2.047684 1.065367
H 1.838365 0.244055 2.875444
H 1.166214 -1.305539 3.493441
H 0.264500 0.235521 3.727955
H 0.951280 1.596121 0.381597
H -1.525834 1.375499 1.611785
H -4.386662 -1.159752 -2.501137
H 4.951122 2.236861 -1.200179
H -3.411556 -3.298701 -1.652092
H -4.643947 1.301224 -2.330297
H -2.562472 3.493783 0.790427
H 6.466867 0.418787 -1.474390
H 6.321420 -0.888195 -0.282367
H 5.707320 -1.114854 -1.951147
H 1.799039 3.786542 -1.264301
H 2.342539 4.039728 0.409879
H 3.515009 4.148455 -0.931796
H -4.112266 3.469199 -1.190200
H 4.561219 -2.300858 -0.331593
H -2.052393 -4.302832 -0.094614


