%chk=000296523.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296523

0 1
O -5.652579 -1.364065 -0.840370
O -6.253775 0.520042 0.473506
O 4.978958 1.704137 -0.598864
O 5.588057 -1.118595 -0.019420
N -0.445418 -1.686896 -0.000419
C 0.208836 0.771055 -0.245078
C -0.776394 -0.378468 -0.608610
C -0.141721 1.370384 1.129244
C -1.542091 1.985088 1.094667
C -2.217349 -0.061093 -0.244972
C 1.643083 0.293013 -0.220927
C -2.572378 1.038840 0.542850
C 1.921878 -1.054129 0.093931
C -3.201612 -0.952059 -0.758546
C -3.934358 1.326717 0.841429
C 0.776284 -1.967547 0.302947
C 2.690651 1.182286 -0.475945
C -4.509863 -0.665546 -0.459460
C -4.873073 0.465473 0.330647
C 3.243067 -1.503880 0.184090
C 4.017158 0.731521 -0.406554
C 4.291373 -0.610769 -0.057004
C -6.780629 -0.640441 -0.252408
C 6.036441 1.368837 -1.540111
C 6.326473 -0.704775 1.164490
H 0.094459 1.566486 -1.024161
H -0.727442 -0.522870 -1.728604
H 0.605298 2.132562 1.420134
H -0.093748 0.578417 1.904543
H -1.540345 2.911839 0.481092
H -1.826525 2.306883 2.118695
H -2.916911 -1.829141 -1.337096
H -4.211737 2.183158 1.447842
H 0.995593 -2.954419 0.736723
H 2.502365 2.225046 -0.729770
H 3.474680 -2.539100 0.436329
H -7.263428 -1.302273 0.478383
H -7.406491 -0.266282 -1.072690
H 6.751564 2.182885 -1.379967
H 5.622264 1.393268 -2.552028
H 6.477764 0.390357 -1.316808
H 7.310511 -1.153875 0.992009
H 5.852150 -1.120718 2.057276
H 6.383262 0.387447 1.214786


%chk=000296523-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296523

0 1
O -5.713844 -1.240788 -1.094077
O -6.350648 0.606365 0.298267
O 5.096133 1.631737 -0.602282
O 5.656551 -1.165227 0.090927
N -0.470441 -1.727828 0.057148
C 0.208940 0.762525 -0.130924
C -0.768156 -0.374861 -0.541970
C -0.165477 1.308227 1.275173
C -1.559571 1.961272 1.223703
C -2.232477 -0.030653 -0.254713
C 1.654493 0.283538 -0.166364
C -2.606841 1.059502 0.576460
C 1.924212 -1.085051 0.126014
C -3.223295 -0.870874 -0.845073
C -3.987029 1.336524 0.819688
C 0.782035 -1.998738 0.329571
C 2.732790 1.157968 -0.404168
C -4.558908 -0.580079 -0.590341
C -4.935118 0.507426 0.226863
C 3.261860 -1.540605 0.217810
C 4.068726 0.697734 -0.354552
C 4.337368 -0.659555 -0.001760
C -6.850420 -0.631948 -0.357949
C 5.999266 1.296241 -1.730915
C 6.464071 -0.570235 1.182919
H 0.084128 1.596582 -0.851115
H -0.661471 -0.530957 -1.639154
H 0.590502 2.045785 1.603328
H -0.154827 0.476817 2.006257
H -1.489565 2.911182 0.651533
H -1.889087 2.239122 2.242936
H -2.929543 -1.726548 -1.458541
H -4.287651 2.172082 1.458929
H 0.994928 -3.005954 0.722407
H 2.562711 2.211743 -0.651783
H 3.486167 -2.584411 0.465686
H -7.195629 -1.337003 0.422689
H -7.640331 -0.362316 -1.075533
H 6.770207 2.081321 -1.728730
H 5.434797 1.324044 -2.681713
H 6.454085 0.299548 -1.593158
H 7.455431 -1.041363 1.103484
H 6.010355 -0.809244 2.163222
H 6.544876 0.525751 1.065601


