%chk=000274303.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274303

0 1
O 1.395532 -0.152905 -2.580376
O -4.536299 3.171345 1.532508
O -3.604441 1.520063 2.569407
N -1.284436 -2.045635 -0.108550
N -3.798614 2.198611 1.572570
C -0.708739 -0.903408 -0.910165
C -0.352998 -3.227493 -0.122550
C -2.624269 -2.453193 -0.660908
C 2.214809 0.103080 1.539020
C -0.918963 -4.341266 0.774006
C -3.235311 -3.549629 0.226943
C 0.639220 -0.465125 -0.359537
C -2.314169 -4.772553 0.306706
C 0.897350 -0.356943 0.949691
C 3.272119 0.411161 0.482636
C -1.619267 0.315816 -0.854842
C 1.654679 -0.107756 -1.390092
C 2.992333 0.307358 -0.890317
C 2.727762 -1.025711 2.454082
C 1.930754 1.382466 2.349293
C 4.556989 0.814476 0.884385
C -2.294449 0.667257 0.321029
C -1.737697 1.127371 -1.994194
C 3.987566 0.602918 -1.839803
C 5.539940 1.104982 -0.062283
C 5.258370 0.999526 -1.430185
C -3.089723 1.820852 0.331459
C -2.538183 2.274960 -1.969405
C -3.223266 2.630759 -0.807807
H -0.567371 -1.203437 -1.991536
H 0.634488 -2.906600 0.271571
H -0.178078 -3.617041 -1.148933
H -2.559811 -2.807576 -1.712413
H -3.294861 -1.567488 -0.660030
H -0.973597 -3.979313 1.820319
H -0.227038 -5.202846 0.775329
H -4.227519 -3.835388 -0.167014
H -3.407316 -3.145025 1.245017
H -2.250663 -5.268675 -0.680105
H -2.734892 -5.522916 1.001269
H 0.129471 -0.614547 1.690550
H 1.990000 -1.290276 3.220689
H 2.950093 -1.933126 1.879840
H 3.645515 -0.737110 2.978562
H 1.569854 2.191537 1.701836
H 1.169361 1.213138 3.119924
H 2.828963 1.748358 2.858768
H 4.790870 0.902935 1.944588
H -2.207968 0.042977 1.220757
H -1.188281 0.866641 -2.904809
H 3.743198 0.516114 -2.903598
H 6.532533 1.416443 0.264282
H 6.026733 1.227145 -2.166636
H -2.623894 2.895797 -2.861895
H -3.854391 3.523994 -0.771955


%chk=000274303-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274303

0 1
O 1.366485 -0.021171 -2.634971
O -4.384720 3.438659 1.363214
O -3.513565 1.665640 2.499374
N -1.288170 -2.083690 -0.097769
N -3.674589 2.360934 1.421945
C -0.699945 -0.982913 -0.922656
C -0.427383 -3.305332 -0.125555
C -2.666915 -2.443808 -0.547441
C 2.266324 -0.034607 1.558119
C -0.973196 -4.392582 0.821347
C -3.295154 -3.498137 0.385065
C 0.670930 -0.535791 -0.389193
C -2.423732 -4.771546 0.449159
C 0.971728 -0.517050 0.942371
C 3.277144 0.447300 0.510369
C -1.596398 0.266101 -0.949148
C 1.650115 -0.039475 -1.388223
C 2.970972 0.438381 -0.881456
C 2.869520 -1.219143 2.387053
C 1.907904 1.135787 2.537383
C 4.551402 0.921603 0.914832
C -2.237220 0.717345 0.227150
C -1.731764 1.020121 -2.141217
C 3.926411 0.895677 -1.829914
C 5.496025 1.372825 -0.028780
C 5.183977 1.360565 -1.411983
C -3.003247 1.897951 0.181230
C -2.503028 2.206741 -2.163954
C -3.152490 2.660798 -0.999469
H -0.545402 -1.306060 -1.980338
H 0.598244 -3.028981 0.170964
H -0.370682 -3.716543 -1.167303
H -2.644558 -2.840803 -1.596269
H -3.292875 -1.536472 -0.556138
H -0.945641 -4.008461 1.859949
H -0.311738 -5.279165 0.775555
H -4.314053 -3.738507 0.025690
H -3.393425 -3.062374 1.398236
H -2.430245 -5.272035 -0.541258
H -2.838454 -5.492671 1.178404
H 0.213892 -0.889978 1.647530
H 2.131153 -1.585334 3.123679
H 3.154355 -2.058179 1.728358
H 3.768347 -0.892304 2.939039
H 1.485377 1.994824 1.988294
H 1.164770 0.798951 3.282767
H 2.806992 1.478251 3.079475
H 4.811863 0.940769 1.978827
H -2.154446 0.151969 1.159721
H -1.211450 0.681057 -3.043469
H 3.644816 0.871701 -2.887591
H 6.473366 1.734777 0.309623
H 5.917466 1.711455 -2.145542
H -2.595659 2.777179 -3.093718
H -3.757435 3.570852 -0.984268


