%chk=000218082.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218082

0 1
O 4.038485 0.211447 1.485902
O 4.966232 -0.870093 -1.681026
N 0.710981 0.218559 -0.161780
C -0.738168 0.436536 0.204449
C 3.631030 -0.017712 0.123898
C 1.299808 -0.958391 0.560665
C 1.543326 1.436129 0.116980
C 2.713467 -1.243309 0.036470
C 2.956643 1.238052 -0.448599
C -1.312938 1.619055 -0.606014
C -1.555084 -0.825607 -0.155446
C -2.750406 1.911910 -0.166213
C -3.037147 -0.610385 -0.032834
C -3.604551 0.677627 -0.064871
C 4.970446 -0.277854 -0.627147
C -3.874870 -1.731228 0.086383
C -4.998060 0.822829 0.024915
C 6.205731 0.258066 0.015005
C -5.259301 -1.577075 0.174714
C -5.822365 -0.297280 0.143739
H -0.855753 0.647298 1.298663
H 0.663188 -1.850857 0.363554
H 1.318336 -0.820542 1.663710
H 1.594079 1.687003 1.198705
H 1.071807 2.310323 -0.390423
H 3.157897 -2.091277 0.590965
H 2.657886 -1.564549 -1.029819
H 2.895551 1.141975 -1.555037
H 3.572898 2.131211 -0.235272
H -1.281537 1.373691 -1.687203
H -0.689761 2.526745 -0.488742
H -1.237494 -1.680056 0.475679
H -1.321367 -1.125371 -1.203135
H -3.208135 2.632998 -0.875176
H -2.747801 2.423034 0.820496
H 3.255624 0.317791 2.061907
H -3.443306 -2.730257 0.107427
H -5.441563 1.816487 0.000580
H 6.218039 1.356996 0.005535
H 6.256401 -0.032619 1.079925
H 7.115360 -0.097343 -0.487020
H -5.899214 -2.452186 0.266390
H -6.901199 -0.174370 0.211201


%chk=000218082-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218082

0 1
O 3.975153 0.165770 1.560964
O 5.062855 -0.143021 -1.863577
N 0.717830 0.310611 -0.232834
C -0.732626 0.501929 0.098167
C 3.682983 0.100500 0.112236
C 1.336672 -0.922320 0.314994
C 1.533163 1.485813 0.167592
C 2.772158 -1.113466 -0.215515
C 2.974327 1.396289 -0.368969
C -1.380231 1.540649 -0.851942
C -1.540115 -0.811231 -0.019359
C -2.804181 1.898636 -0.379807
C -3.051492 -0.606979 0.086643
C -3.656845 0.665512 -0.104166
C 5.044206 -0.050487 -0.606327
C -3.876291 -1.727092 0.365413
C -5.067505 0.781007 -0.017852
C 6.303073 -0.077854 0.233819
C -5.278689 -1.604600 0.449001
C -5.880325 -0.338681 0.255258
H -0.837656 0.879249 1.151724
H 0.745731 -1.800914 0.012632
H 1.341714 -0.911964 1.442664
H 1.547600 1.593789 1.289644
H 1.072892 2.408233 -0.222704
H 3.209720 -2.028738 0.225747
H 2.742332 -1.233273 -1.312802
H 2.957160 1.391226 -1.472877
H 3.552010 2.276548 -0.029723
H -1.405328 1.104918 -1.869239
H -0.776422 2.463272 -0.910499
H -1.234435 -1.535168 0.758485
H -1.299035 -1.272409 -1.000602
H -3.302519 2.537575 -1.133642
H -2.739298 2.509533 0.545482
H 3.116265 0.239201 2.050515
H -3.408317 -2.708493 0.516874
H -5.530894 1.764354 -0.170377
H 6.372821 0.841171 0.843753
H 6.255102 -0.907649 0.962188
H 7.185018 -0.181634 -0.416790
H -5.896465 -2.483906 0.662910
H -6.968918 -0.228505 0.314999


