%chk=000279854.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279854

0 1
O -3.937574 -0.604897 -1.623944
O -1.026122 -0.636904 0.044984
O -0.047076 -2.633468 0.480302
O 1.369228 3.429913 -0.436597
O 4.983032 -2.518341 0.484528
O 3.536540 3.469984 -0.427235
O 6.036149 -0.639724 0.237127
N 2.462460 2.904252 -0.351998
N 5.027692 -1.315067 0.313899
C -2.368196 -1.239773 0.137045
C -2.831544 -1.556254 -1.319009
C -3.284535 -0.144417 0.570975
C -4.154506 0.168810 -0.505670
C -3.395940 -2.946226 -1.487966
C -3.393947 0.554981 1.764707
C -5.132225 1.156486 -0.425928
C -4.374244 1.553934 1.866398
C -5.222467 1.846617 0.789755
C 0.056674 -1.450929 0.254397
C 1.311310 -0.657126 0.154238
C 2.533542 -1.334023 0.276439
C 1.277831 0.729178 -0.052025
C 2.489218 1.434094 -0.135636
C 3.728870 -0.603733 0.187042
C 3.724469 0.782516 -0.018889
H -2.317250 -2.120666 0.807957
H -2.053833 -1.298167 -2.067913
H -2.627019 -3.717596 -1.344533
H -4.214302 -3.150145 -0.783209
H -3.818533 -3.079134 -2.495458
H -2.733691 0.336364 2.602279
H -5.783509 1.377066 -1.265918
H -4.474656 2.112355 2.794828
H -5.973566 2.631457 0.897837
H 2.556517 -2.425568 0.441271
H 0.313307 1.260046 -0.147272
H 4.671498 1.347703 -0.087207


%chk=000279854-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279854

0 1
O -3.823945 -0.659282 -1.701059
O -1.015509 -0.491283 0.131556
O 0.005185 -2.594153 0.106604
O 1.559551 3.605264 0.071982
O 4.990033 -2.678036 -0.029716
O 3.840367 3.549109 -0.004641
O 6.176286 -0.727743 -0.059683
N 2.685129 2.980629 0.033905
N 5.073644 -1.393032 -0.031331
C -2.375930 -1.172806 0.206453
C -2.823522 -1.678051 -1.198802
C -3.394261 -0.123219 0.548740
C -4.170441 0.142586 -0.604821
C -3.496972 -3.051339 -1.155862
C -3.625544 0.589947 1.739966
C -5.181114 1.120923 -0.619970
C -4.641550 1.575795 1.751910
C -5.402472 1.834665 0.581681
C 0.080751 -1.340624 0.103231
C 1.371323 -0.575611 0.068625
C 2.576848 -1.314708 0.036126
C 1.398724 0.838753 0.067304
C 2.647913 1.488605 0.033896
C 3.798936 -0.617715 0.003014
C 3.868038 0.788131 0.000693
H -2.264630 -2.003025 0.923712
H -1.989731 -1.658290 -1.919398
H -2.759930 -3.819418 -0.860655
H -4.331845 -3.061224 -0.432648
H -3.897849 -3.309559 -2.149806
H -3.026768 0.394614 2.636219
H -5.766340 1.313861 -1.522952
H -4.841176 2.144649 2.665449
H -6.183409 2.602783 0.607303
H 2.554465 -2.408529 0.037200
H 0.472675 1.418341 0.091215
H 4.826673 1.312594 -0.025840


