%chk=000285345.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285345

0 1
O -1.281481 2.303094 0.584511
O -3.261656 1.231544 -1.691092
O 4.437205 0.009584 1.065186
O 4.775469 -1.304516 -0.883405
O -0.430760 3.761394 -0.921266
N -1.061231 -2.413795 0.316951
C -1.620193 -1.072498 0.651242
C -0.508425 0.047936 0.586146
C -2.183977 -1.254388 2.087471
C -1.080987 1.173771 -0.323945
C -1.846163 -3.457326 1.060940
C -2.625593 -2.723472 2.170227
C -2.717941 -0.565359 -0.273668
C 0.856898 -0.382680 0.117072
C -0.915766 -2.727621 -1.133197
C -2.430835 0.646248 -0.779594
C -0.096229 -1.646090 -1.862722
C 1.060863 -1.160414 -1.034700
C 1.956309 0.062922 0.902561
C 2.366818 -1.528894 -1.457495
C 3.212068 -0.299853 0.480467
C 3.415973 -1.087458 -0.688107
C -0.858772 3.555106 0.190575
C -3.015763 2.619384 -2.031382
C 5.454450 -0.621855 0.221611
C -1.047294 4.502896 1.320647
H -0.415722 0.477109 1.619670
H -3.014398 -0.558491 2.285571
H -1.403048 -1.043685 2.839517
H -0.413374 1.481010 -1.156379
H -1.104965 -4.166448 1.486640
H -2.528999 -4.039910 0.413127
H -2.410592 -3.151074 3.163101
H -3.714040 -2.817721 2.015980
H -3.598769 -1.153134 -0.452190
H -1.890756 -2.856612 -1.652872
H -0.374802 -3.700065 -1.192207
H -0.752176 -0.794872 -2.139282
H 0.252465 -2.060087 -2.830989
H 1.808471 0.657935 1.799216
H 2.524201 -2.137882 -2.342599
H -1.983874 2.771925 -2.369273
H -3.252950 3.252443 -1.172410
H -3.727206 2.779264 -2.850906
H 5.966318 -1.383805 0.823555
H 6.077729 0.173404 -0.207099
H -0.072019 4.824214 1.723356
H -1.617540 4.059366 2.153449
H -1.574441 5.411754 0.990491


%chk=000285345-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000285345

0 1
O -1.318384 2.432863 0.411048
O -3.672826 1.239913 -1.350709
O 4.382099 0.071177 1.335813
O 4.839492 -1.131111 -0.691781
O -0.198980 3.548276 -1.316917
N -1.141091 -2.440046 0.172518
C -1.650212 -1.139747 0.704538
C -0.619994 0.062052 0.567882
C -1.885585 -1.530988 2.191667
C -1.290419 1.129598 -0.357608
C -1.872210 -3.560899 0.820247
C -2.462679 -2.967267 2.133656
C -2.899854 -0.602098 0.013034
C 0.801909 -0.316218 0.179969
C -0.917469 -2.624689 -1.268787
C -2.701260 0.610213 -0.571684
C -0.070768 -1.492183 -1.911139
C 1.075499 -1.035262 -1.023162
C 1.867467 0.080816 1.037424
C 2.413750 -1.355861 -1.382769
C 3.170436 -0.253522 0.665318
C 3.438866 -0.957268 -0.522172
C -0.673671 3.540282 -0.157776
C -3.445633 2.624525 -1.799225
C 5.437137 -0.660989 0.586341
C -0.632695 4.687608 0.827486
H -0.579599 0.545800 1.560840
H -2.552166 -0.812935 2.699771
H -0.908081 -1.532117 2.709116
H -0.735173 1.337963 -1.290639
H -1.176029 -4.401995 1.008038
H -2.690628 -3.952901 0.168940
H -2.187323 -3.560762 3.021654
H -3.565800 -2.940520 2.082181
H -3.840408 -1.157185 -0.038502
H -1.875628 -2.715800 -1.841749
H -0.380094 -3.587114 -1.385966
H -0.738963 -0.645969 -2.152788
H 0.316071 -1.860454 -2.878561
H 1.670745 0.631350 1.962094
H 2.632296 -1.902450 -2.304568
H -2.449406 2.751246 -2.259553
H -3.559489 3.331577 -0.956947
H -4.227825 2.809605 -2.550561
H 5.756557 -1.539960 1.178831
H 6.263500 0.031093 0.362334
H 0.259745 4.580206 1.471316
H -1.520562 4.682638 1.478790
H -0.552165 5.641803 0.285224


