%chk=000289718.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289718

0 1
O 5.027071 -1.163962 0.003855
O -4.687260 -1.589979 -0.356070
O -1.196757 3.360208 0.118601
N 0.059182 2.765703 0.109288
C 1.327661 0.740904 0.031496
C -1.214433 0.648328 -0.018403
C 0.031511 1.459416 0.044050
C 1.356617 -0.659955 -0.056203
C -1.848976 0.247741 1.162345
C 2.548573 1.449708 0.107234
C -1.760915 0.304609 -1.269638
C 3.760134 -0.629701 0.005792
C -3.547777 -0.848799 -0.138388
C 2.566703 -1.357987 -0.070154
C -3.023008 -0.510941 1.114864
C 3.762770 0.778898 0.095442
C -2.925608 -0.447820 -1.340979
C 5.157221 -2.603576 -0.088437
C -5.436804 -2.037007 0.799394
H 0.422975 -1.225262 -0.115360
H -1.427449 0.529749 2.128335
H 2.538342 2.541687 0.175861
H -1.265719 0.634886 -2.184119
H 2.563874 -2.440085 -0.139261
H -3.506593 -0.815729 2.036072
H 4.710183 1.310283 0.152843
H -3.370672 -0.727087 -2.293164
H 4.736711 -2.963436 -1.031739
H 4.691945 -3.083383 0.777199
H 6.247738 -2.730940 -0.069984
H -4.829335 -2.711903 1.408711
H -6.271649 -2.574191 0.330179
H -5.797303 -1.178955 1.374047
H -0.968455 4.348181 0.163391


%chk=000289718-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289718

0 1
O 5.187110 -1.023942 -0.593223
O -4.710600 -1.767896 -0.505170
O -1.157575 3.185470 1.129993
N 0.148720 2.552353 0.899074
C 1.362973 0.659742 0.173999
C -1.217524 0.526565 0.262094
C 0.043425 1.297097 0.468729
C 1.552736 -0.737777 0.328673
C -2.316569 0.608675 1.156894
C 2.480019 1.447148 -0.233381
C -1.343470 -0.327737 -0.873464
C 3.899960 -0.540075 -0.319058
C -3.593184 -0.983165 -0.189271
C 2.805472 -1.342683 0.086972
C -3.490877 -0.144262 0.948825
C 3.729748 0.860089 -0.478238
C -2.513906 -1.067257 -1.104980
C 5.416366 -2.463078 -0.442313
C -5.858190 -1.714572 0.404633
H 0.716091 -1.362895 0.657462
H -2.250398 1.268909 2.024572
H 2.345727 2.525797 -0.355762
H -0.515929 -0.398735 -1.586952
H 2.914438 -2.422588 0.223919
H -4.312926 -0.062602 1.666142
H 4.588160 1.458103 -0.799023
H -2.617342 -1.712987 -1.982070
H 4.772354 -3.047596 -1.127942
H 5.241301 -2.790947 0.600896
H 6.473142 -2.614741 -0.706413
H -5.584723 -2.066262 1.418455
H -6.603897 -2.393034 -0.034818
H -6.275242 -0.690757 0.466542
H -0.884889 4.105242 1.381307


