%chk=000276588.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276588

0 1
O -4.504837 0.575096 -0.265466
N -0.325578 -2.037396 0.463156
C 1.077935 -0.075863 0.244718
C 1.970951 0.148330 -1.001260
C 1.660760 0.579884 1.510102
C 2.298091 1.642440 -1.183433
C 3.263982 -0.691493 -0.901998
C 0.915690 -1.614817 0.455964
C -0.382164 0.296137 0.043619
C 1.975552 2.065115 1.294747
C 2.888467 2.279104 0.080998
C 2.985858 -2.189953 -0.727293
C 2.126309 -2.476882 0.516844
C -1.168211 -0.886889 0.224025
C -1.004924 1.501138 -0.233506
C -2.552196 -0.878278 0.139290
C -2.401855 1.543362 -0.330993
C -3.148829 0.366192 -0.142073
C -5.384021 -0.562781 -0.093303
H 1.397581 -0.194654 -1.898729
H 2.582951 0.045113 1.809680
H 0.948541 0.465481 2.350528
H 1.372590 2.179917 -1.471879
H 2.996822 1.772571 -2.030848
H 3.882457 -0.325090 -0.059509
H 3.872365 -0.533473 -1.812634
H 2.451528 2.479476 2.203551
H 1.032763 2.631802 1.162004
H 3.047923 3.361312 -0.084056
H 3.889414 1.852063 0.284779
H 3.940384 -2.744219 -0.652597
H 2.472682 -2.586024 -1.626728
H 2.697181 -2.270394 1.445605
H 1.852336 -3.552671 0.560762
H -0.421525 2.411314 -0.375991
H -3.121278 -1.789962 0.281528
H -2.921206 2.472467 -0.549818
H -5.286318 -0.968881 0.917684
H -5.180730 -1.318719 -0.857410
H -6.371539 -0.107475 -0.241755


%chk=000276588-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276588

0 1
O -4.609831 0.550514 -0.269731
N -0.353667 -2.004380 0.441749
C 1.073853 -0.057193 0.251765
C 2.008822 0.159417 -1.002586
C 1.702876 0.609380 1.525599
C 2.360967 1.659508 -1.188495
C 3.282828 -0.731075 -0.915083
C 0.898587 -1.573230 0.469256
C -0.390568 0.341529 0.049801
C 2.051004 2.100604 1.312247
C 2.968911 2.302096 0.082793
C 2.962049 -2.233044 -0.732720
C 2.091685 -2.476785 0.538552
C -1.172742 -0.840440 0.203934
C -1.051518 1.559833 -0.207609
C -2.576810 -0.847339 0.111679
C -2.460998 1.580963 -0.308973
C -3.217815 0.390512 -0.148512
C -5.439117 -0.646160 -0.116346
H 1.435753 -0.174799 -1.892810
H 2.628205 0.063344 1.797385
H 1.000473 0.494966 2.372258
H 1.445573 2.213418 -1.473444
H 3.066006 1.761721 -2.037576
H 3.932495 -0.396312 -0.082553
H 3.867545 -0.587323 -1.845211
H 2.544657 2.491965 2.222992
H 1.120133 2.685887 1.184147
H 3.138370 3.382222 -0.091053
H 3.963087 1.858151 0.290491
H 3.897800 -2.818801 -0.659451
H 2.410321 -2.605294 -1.618681
H 2.701875 -2.251243 1.437180
H 1.761093 -3.526942 0.606329
H -0.503179 2.497871 -0.338236
H -3.121178 -1.786570 0.237099
H -2.999080 2.511626 -0.513131
H -5.318266 -1.094549 0.889296
H -5.199873 -1.403830 -0.888109
H -6.474424 -0.297818 -0.245939


