%chk=000107082.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000107082

0 1
O -3.315816 1.469089 0.105588
O -6.515644 -1.772542 0.495096
N -4.385902 -0.209536 -0.994081
C 1.760918 0.326959 0.034451
C 3.104190 -0.130199 -0.549814
C 0.585776 -0.116469 -0.847729
C 4.278085 0.312444 0.334161
C -0.751632 0.346144 -0.259226
C 5.621291 -0.144747 -0.249597
C -1.933633 -0.099480 -1.130653
C 6.796246 0.296962 0.635276
C -3.230627 0.477380 -0.598022
C -5.724523 0.263947 -0.582108
C -6.170752 -0.391755 0.746403
C 8.112313 -0.151316 0.070889
C -7.455182 0.228420 1.275435
C 9.092344 -0.672980 0.806148
H 1.753510 1.429103 0.144774
H 1.637947 -0.077363 1.057981
H 3.228585 0.277121 -1.571790
H 3.111882 -1.231710 -0.660934
H 0.711028 0.290325 -1.870008
H 0.593335 -1.217997 -0.956969
H 4.270831 1.414039 0.445834
H 4.153464 -0.094209 1.356514
H -0.877034 -0.044912 0.769779
H -0.768730 1.452268 -0.153550
H 5.745213 0.259944 -1.272622
H 5.632236 -1.247142 -0.356727
H -1.964484 -1.204342 -1.187255
H -1.790068 0.255623 -2.173738
H 6.653902 -0.085293 1.666522
H 6.806189 1.403810 0.730985
H -6.459700 0.033650 -1.383346
H -5.701545 1.374214 -0.455995
H -4.355666 -1.035779 -1.575722
H -5.354167 -0.360864 1.501545
H 8.223003 -0.006604 -1.005705
H -7.807862 -0.319279 2.160984
H -8.265956 0.171215 0.537758
H -7.315493 1.277059 1.558416
H -5.712443 -2.311478 0.392390
H 10.042522 -0.978306 0.393996
H 9.025549 -0.836414 1.871268


%chk=000107082-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000107082

0 1
O -3.485410 1.681279 -0.358153
O -5.859823 -1.562108 1.294190
N -4.416310 -0.354882 -0.971150
C 1.700693 0.241642 0.011198
C 3.098203 -0.044328 -0.583325
C 0.546373 -0.027546 -0.980413
C 4.248368 0.208569 0.417237
C -0.841322 0.300439 -0.388379
C 5.647512 -0.059341 -0.181098
C -1.997752 0.001694 -1.371795
C 6.794868 0.188573 0.835257
C -3.343227 0.521530 -0.854377
C -5.787124 0.043897 -0.598890
C -6.071610 -0.149239 0.910318
C 8.168463 -0.013382 0.231166
C -7.523723 0.176214 1.261340
C 9.104280 -0.890194 0.675392
H 1.654345 1.298580 0.346392
H 1.555008 -0.378743 0.920189
H 3.249611 0.587974 -1.483171
H 3.141146 -1.097253 -0.932630
H 0.703847 0.576983 -1.898477
H 0.578207 -1.091091 -1.298540
H 4.198322 1.258148 0.775917
H 4.103336 -0.432251 1.311965
H -0.993265 -0.276417 0.546640
H -0.894973 1.369636 -0.109966
H 5.798622 0.589654 -1.068709
H 5.705956 -1.104832 -0.544610
H -2.046031 -1.082625 -1.596352
H -1.790513 0.519893 -2.330120
H 6.667583 -0.477554 1.710859
H 6.706828 1.230735 1.210835
H -6.498359 -0.568359 -1.182690
H -5.921745 1.109626 -0.859632
H -4.269762 -1.261741 -1.416077
H -5.379790 0.504904 1.480268
H 8.399183 0.611426 -0.647385
H -7.693750 0.032329 2.341349
H -8.210969 -0.494377 0.714436
H -7.764938 1.223117 1.003331
H -4.895844 -1.767518 1.183658
H 10.080162 -0.989442 0.186421
H 8.918825 -1.534618 1.544183


