%chk=000203260.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203260

0 1
O 1.024457 -0.235279 -2.965216
O -2.467091 0.373361 2.521806
O -5.261030 -1.006339 -0.332589
O -4.906139 -0.389084 1.815485
N 3.751737 0.385238 -0.750825
N 0.962599 0.407716 -0.743804
C 5.971434 -0.400301 0.992083
C 4.756408 -1.307192 0.763361
C 5.577464 1.067128 0.785841
C 4.134999 -1.061495 -0.620564
C 4.944659 1.284053 -0.598737
C 3.067817 0.629433 -2.056163
C 1.598693 0.203323 -1.989673
C -0.394462 0.141542 -0.432775
C -0.802847 0.369970 0.890829
C -1.318919 -0.323962 -1.403578
C -2.143356 0.132570 1.234421
C -3.083416 -0.331759 0.275925
C -2.633241 -0.551952 -1.045803
C -4.457020 -0.560857 0.685361
C -6.652982 -1.255701 0.012817
H 6.369444 -0.547522 2.013599
H 6.790641 -0.677317 0.301746
H 5.043218 -2.371073 0.856293
H 3.997408 -1.120672 1.549605
H 4.859633 1.374077 1.573063
H 6.459538 1.724511 0.896012
H 4.837431 -1.391248 -1.416234
H 3.211674 -1.671985 -0.730162
H 4.595741 2.336033 -0.686351
H 5.705464 1.122614 -1.392499
H 3.089068 1.716338 -2.306833
H 3.535399 0.108828 -2.924565
H 1.563356 0.721076 0.039411
H -0.122734 0.724409 1.661556
H -0.984871 -0.501933 -2.431768
H -3.354968 -0.910834 -1.787681
H -3.464337 0.184931 2.729206
H -6.705971 -2.033426 0.781333
H -7.073412 -1.588290 -0.941937
H -7.114686 -0.328630 0.367404


%chk=000203260-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203260

0 1
O 1.054091 -0.011173 -3.397895
O -2.116673 -0.044695 2.545142
O -5.246029 -0.832021 -0.222383
O -4.598741 -0.532063 1.991300
N 3.723812 0.354617 -0.881124
N 1.077337 0.213908 -1.036540
C 5.647860 -0.250378 1.264333
C 4.534108 -1.244622 0.863332
C 5.219457 1.197102 0.930237
C 4.136820 -1.055655 -0.613683
C 4.809222 1.321925 -0.550803
C 3.161792 0.520978 -2.242977
C 1.649424 0.196513 -2.300780
C -0.263166 0.009634 -0.650635
C -0.560666 0.076353 0.731799
C -1.298972 -0.256334 -1.602086
C -1.880538 -0.118661 1.186985
C -2.932477 -0.386682 0.240327
C -2.606450 -0.448299 -1.143844
C -4.289733 -0.583107 0.747594
C -6.629933 -1.033111 0.270721
H 5.880349 -0.344780 2.341363
H 6.577641 -0.496294 0.710664
H 4.865345 -2.288541 1.020183
H 3.642971 -1.082459 1.501229
H 4.358488 1.484982 1.564704
H 6.041224 1.907194 1.141837
H 4.997247 -1.337681 -1.270427
H 3.292210 -1.720222 -0.874748
H 4.438481 2.342320 -0.761057
H 5.705557 1.148919 -1.197569
H 3.275133 1.575144 -2.560655
H 3.664098 -0.103479 -3.012974
H 1.807718 0.391146 -0.315819
H 0.218026 0.280807 1.473669
H -1.050172 -0.304064 -2.663206
H -3.411769 -0.651945 -1.855515
H -3.114600 -0.209598 2.697223
H -6.670104 -1.899642 0.951431
H -7.223419 -1.211124 -0.636633
H -6.978169 -0.134612 0.806678


