%chk=000217691.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217691

0 1
O -1.225645 2.224956 -0.762513
O -1.368703 -2.360338 -0.129102
O 4.629712 -0.345120 -0.052052
N -0.943515 -0.078874 -0.447318
C -3.173907 0.736154 -0.774048
C -3.223846 -0.811837 -0.544062
C -4.031328 1.299263 0.409638
C -4.100871 -0.952784 0.745687
C -3.655774 0.307031 1.559939
C -5.461881 0.828937 0.119480
C -5.503208 -0.501994 0.318502
C -1.705067 1.123968 -0.674298
C -1.780607 -1.248043 -0.333489
C 0.497076 -0.107174 -0.324763
C 1.183337 1.019437 0.151648
C 1.205820 -1.273703 -0.691347
C 2.577358 0.998385 0.262368
C 2.587268 -1.306486 -0.579242
C 3.265520 -0.162850 -0.103003
C 5.442063 0.780576 0.421505
C 6.799773 0.298163 0.358180
C 7.932540 -0.108505 0.303775
H -3.582717 1.047515 -1.755609
H -3.664983 -1.367191 -1.395644
H -3.893043 2.366572 0.604828
H -4.024749 -1.923132 1.244887
H -4.240273 0.461568 2.476051
H -2.598833 0.316371 1.847826
H -6.233553 1.504201 -0.190615
H -6.317211 -1.190333 0.212499
H 0.640362 1.929121 0.424163
H 0.669477 -2.158025 -1.048192
H 3.092067 1.881471 0.625874
H 3.159569 -2.193099 -0.849093
H 5.273153 1.645148 -0.254722
H 5.132730 1.024840 1.459603
H 8.906587 -0.452986 0.258860


%chk=000217691-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217691

0 1
O -1.233578 2.195345 -0.978306
O -1.433945 -2.427236 -0.066889
O 4.679115 -0.409602 -0.124973
N -0.973480 -0.128130 -0.505149
C -3.211589 0.701857 -0.808999
C -3.277691 -0.823571 -0.511982
C -4.023752 1.342580 0.400236
C -4.118722 -0.896740 0.836633
C -3.606256 0.387329 1.563173
C -5.477029 0.895064 0.187796
C -5.533810 -0.444052 0.448586
C -1.726681 1.058959 -0.788484
C -1.827597 -1.267885 -0.332267
C 0.464461 -0.170711 -0.390936
C 1.165279 0.910306 0.190323
C 1.182265 -1.299113 -0.868065
C 2.572067 0.875377 0.296417
C 2.580815 -1.341158 -0.756728
C 3.282424 -0.255496 -0.176610
C 5.443739 0.707274 0.474649
C 6.869122 0.373168 0.442967
C 8.077254 0.136461 0.438587
H -3.641315 1.006117 -1.776499
H -3.747644 -1.429573 -1.302833
H -3.843534 2.419497 0.524915
H -4.023694 -1.858787 1.358960
H -4.163464 0.591603 2.491249
H -2.522746 0.381702 1.779610
H -6.276709 1.536627 -0.190943
H -6.389441 -1.112868 0.325653
H 0.621407 1.789056 0.542992
H 0.648042 -2.143576 -1.307817
H 3.085122 1.730809 0.744704
H 3.149880 -2.203730 -1.114802
H 5.255336 1.638005 -0.100030
H 5.110835 0.866640 1.521491
H 9.130212 -0.080342 0.429571


