%chk=000213197.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213197

0 1
O -1.019451 1.890301 -0.862165
O -1.190635 -1.621491 2.165897
O 0.698644 -0.826564 -2.979553
N -0.707915 0.108210 0.660815
N 1.397804 0.973394 -1.847883
C 0.740065 0.151644 1.024959
C 1.461731 -1.082852 0.500506
C 1.457752 1.413574 0.615120
C 1.689611 -1.313622 -0.860845
C 1.781169 1.751245 -0.714406
C -1.447062 0.948581 -0.251833
C -1.563907 -0.872243 1.301859
C -2.849094 0.400272 -0.230261
C -2.916639 -0.681149 0.688627
C 1.921008 -2.021955 1.439848
C 1.849645 2.291479 1.643288
C 1.198865 -0.417252 -1.942564
C 2.374344 -2.469721 -1.277487
C 2.484119 2.947596 -0.992925
C -3.956324 0.799100 -0.947357
C -4.091089 -1.371717 0.898081
C 2.612004 -3.160856 1.025347
C 2.543002 3.466938 1.369507
C 2.843479 -3.385408 -0.337152
C 2.860035 3.793449 0.043612
C -5.164895 0.093253 -0.735454
C -5.230666 -0.964736 0.164011
H 0.747050 0.096256 2.161217
H 1.718833 -1.870391 2.501564
H 1.599226 2.048515 2.677675
H 1.081589 1.515870 -2.666387
H 2.524743 -2.646320 -2.345955
H 2.732071 3.204627 -2.021949
H -3.907160 1.626688 -1.656429
H -4.145117 -2.203581 1.601248
H 2.965216 -3.880881 1.763659
H 2.834317 4.132575 2.179015
H 3.379138 -4.276334 -0.661761
H 3.402635 4.713493 -0.174777
H -6.053878 0.390669 -1.294235
H -6.171260 -1.497759 0.311822


%chk=000213197-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213197

0 1
O -0.794715 0.201246 -1.794326
O -1.178340 -0.336498 2.873354
O 2.226229 -0.508361 -3.421769
N -0.624402 -0.055553 0.573675
N 2.071256 1.131354 -1.850750
C 0.858709 -0.022045 0.802828
C 1.553674 -1.230671 0.173360
C 1.444438 1.370413 0.578325
C 2.075344 -1.308228 -1.149168
C 1.969480 1.864963 -0.648469
C -1.321907 0.053274 -0.667423
C -1.528664 -0.216188 1.671339
C -2.777755 -0.048390 -0.321130
C -2.900767 -0.208244 1.079554
C 1.633265 -2.381448 1.003933
C 1.415042 2.244415 1.698346
C 2.090074 -0.223074 -2.188727
C 2.640231 -2.535894 -1.597788
C 2.408435 3.220746 -0.719245
C -3.904379 -0.006051 -1.155143
C -4.154866 -0.331351 1.696659
C 2.204573 -3.587170 0.554057
C 1.853499 3.579865 1.627183
C 2.711870 -3.664613 -0.763485
C 2.348333 4.071396 0.396076
C -5.178665 -0.128801 -0.541842
C -5.301986 -0.288948 0.862024
H 0.907436 -0.187656 1.895203
H 1.228879 -2.323983 2.021822
H 1.016750 1.858354 2.644934
H 2.170792 1.701747 -2.698258
H 3.007724 -2.568939 -2.627770
H 2.813607 3.595343 -1.667669
H -3.795575 0.115790 -2.237307
H -4.237838 -0.455306 2.780829
H 2.251713 -4.454243 1.221709
H 1.809690 4.224818 2.510215
H 3.157774 -4.593685 -1.134050
H 2.695103 5.106693 0.309237
H -6.082233 -0.100612 -1.160162
H -6.298823 -0.381571 1.306119


