%chk=000139153.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000139153

0 1
O -5.335994 -1.865454 -0.012010
O -5.898241 0.209068 0.235658
N 1.264949 1.402248 -2.437650
N -5.073569 -0.679152 0.097528
C 0.480177 0.840136 -0.022670
C 1.462048 0.181039 0.971751
C 1.079292 1.635516 1.139330
C -0.965134 0.444237 0.012227
C 2.837498 -0.213748 0.561721
C 0.923032 1.150851 -1.363617
C -1.320962 -0.907549 -0.115414
C -1.954214 1.429385 0.158074
C 3.028322 -1.104225 -0.504831
C 3.942675 0.274140 1.274355
C -2.664506 -1.279740 -0.090077
C -3.300356 1.066694 0.184490
C 4.321490 -1.498435 -0.858667
C 5.232796 -0.126416 0.916379
C -3.645806 -0.288258 0.064022
C 5.424319 -1.011571 -0.149417
H 1.025291 -0.548649 1.676265
H 0.435858 1.935806 1.965632
H 1.811838 2.415267 0.921458
H -0.547571 -1.667369 -0.240376
H -1.670824 2.479904 0.243788
H 2.173458 -1.481311 -1.063273
H 3.796414 0.962585 2.104583
H -2.961592 -2.330290 -0.189423
H -4.086796 1.822228 0.296233
H 4.469570 -2.184371 -1.692173
H 6.091173 0.253674 1.468832
H 6.430664 -1.319639 -0.428227


%chk=000139153-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139153

0 1
O -5.421953 -1.918943 0.016159
O -6.012936 0.284049 0.060556
N 1.304339 1.667487 -2.345694
N -5.133697 -0.660753 0.038981
C 0.473183 0.854963 0.034232
C 1.484649 0.128322 0.973686
C 1.080540 1.565248 1.278755
C -0.987653 0.448885 0.053882
C 2.878076 -0.234044 0.535947
C 0.941484 1.302181 -1.267046
C -1.361717 -0.918054 0.021593
C -1.995648 1.447324 0.071203
C 3.083308 -1.167105 -0.512134
C 4.004252 0.306049 1.205535
C -2.719761 -1.291920 0.017511
C -3.358011 1.094411 0.065454
C 4.389277 -1.553547 -0.882865
C 5.312264 -0.080775 0.837298
C -3.698524 -0.275827 0.041544
C 5.508196 -1.012930 -0.207296
H 0.994609 -0.628750 1.601521
H 0.400003 1.752305 2.114787
H 1.810639 2.355822 1.082650
H -0.586743 -1.691323 -0.003824
H -1.706419 2.503622 0.087202
H 2.220299 -1.578917 -1.049518
H 3.854212 1.026770 2.018164
H -3.032180 -2.339031 -0.007948
H -4.151192 1.846257 0.078578
H 4.535123 -2.267998 -1.700337
H 6.175211 0.343705 1.362192
H 6.522070 -1.310883 -0.496267


