%chk=000294330.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294330

0 1
O -2.696151 -0.069138 -0.115513
O -1.146982 -1.935260 -0.569530
O -1.889632 1.922388 -0.825732
O 0.471975 -1.754064 0.988697
N 2.022149 0.891031 -0.067387
C 4.197527 -0.089664 0.316524
C 4.391160 1.338738 -0.224841
C 2.697400 -0.404697 0.221376
C 3.009263 2.010407 -0.187751
C 0.701422 1.110339 -0.207590
C -0.357308 0.213064 -0.139500
C -1.669987 0.795246 -0.412226
C -0.263147 -1.200696 0.186967
C -4.060987 0.411743 -0.325827
C -1.246184 -3.367532 -0.301739
C -4.471899 1.313667 0.820807
C -0.100906 -4.099583 -0.974195
H 4.543217 -0.161122 1.364549
H 4.795711 -0.819697 -0.255966
H 4.786755 1.313112 -1.257012
H 5.126215 1.900066 0.377386
H 2.468953 -1.134590 -0.585305
H 2.295130 -0.844174 1.171579
H 2.911238 2.690770 0.686518
H 2.813586 2.605408 -1.104246
H 0.414259 2.167780 -0.435388
H -4.612315 -0.545532 -0.348232
H -4.111304 0.920277 -1.304912
H -2.230497 -3.592412 -0.751219
H -1.266924 -3.525032 0.791108
H -4.270538 0.843496 1.791692
H -5.537854 1.560295 0.777647
H -3.908256 2.258844 0.795881
H -0.240888 -5.185198 -0.935091
H -0.005850 -3.808434 -2.027738
H 0.854249 -3.867146 -0.481589


%chk=000294330-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294330

0 1
O -2.778490 0.014849 -0.106440
O -1.044501 -2.082319 -0.651504
O -1.810099 1.974209 -0.923472
O 0.390151 -1.763549 1.156669
N 2.030205 0.859124 0.040338
C 4.246362 -0.034843 0.246100
C 4.322451 1.394468 -0.351190
C 2.762707 -0.439737 0.073243
C 2.976893 2.014080 0.077941
C 0.695837 1.051633 -0.105223
C -0.382688 0.157954 -0.142038
C -1.676871 0.804624 -0.456733
C -0.294418 -1.275437 0.209001
C -4.118588 0.611666 -0.370268
C -1.139655 -3.526286 -0.292631
C -4.559534 1.504017 0.795086
C 0.005025 -4.321550 -0.929543
H 4.508853 -0.012028 1.319619
H 4.926536 -0.744370 -0.253270
H 4.385492 1.348505 -1.453685
H 5.185288 1.971037 0.021582
H 2.585550 -0.972137 -0.882973
H 2.377863 -1.080450 0.884297
H 3.038720 2.421380 1.106985
H 2.626466 2.817311 -0.593394
H 0.408928 2.099163 -0.273095
H -4.774741 -0.266270 -0.487937
H -4.073564 1.184483 -1.313385
H -2.121819 -3.829694 -0.690512
H -1.126699 -3.621300 0.807497
H -4.537844 0.945171 1.746925
H -5.592866 1.861159 0.625653
H -3.898127 2.382161 0.879317
H -0.136754 -5.402395 -0.741132
H 0.032255 -4.162188 -2.021650
H 0.974276 -4.019741 -0.497977


