%chk=000194310.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194310

0 1
O -3.535539 0.936126 2.101355
O -5.319832 0.458401 0.086551
N 1.931933 -2.364004 -0.323398
N 4.558908 0.823296 1.072814
C 0.178281 -0.708026 -0.784489
C 0.496374 -2.039323 -0.062629
C 1.140457 0.388462 -0.378709
C 2.405310 0.058790 0.130993
C 2.832138 -1.370887 0.350244
C -1.274337 -0.366294 -0.534947
C 3.301642 1.107792 0.466658
C 0.778555 1.732369 -0.568718
C 2.252548 -3.745401 0.145943
C -1.675238 0.148574 0.712555
C -2.225319 -0.591724 -1.537593
C 2.925081 2.452674 0.286593
C 1.665136 2.753083 -0.230244
C -3.020775 0.427995 0.925040
C -3.581102 -0.313666 -1.324458
C -3.984848 0.197415 -0.090152
H 0.346615 -0.869450 -1.887457
H 0.247811 -1.962019 1.016919
H -0.137640 -2.848352 -0.484707
H 3.844695 -1.532239 -0.092268
H 2.922894 -1.546037 1.449074
H -0.198610 1.977869 -0.980943
H 3.304329 -3.971628 -0.091992
H 1.636932 -4.464040 -0.419912
H 2.092991 -3.922975 1.219588
H -0.934469 0.334551 1.487660
H -1.916044 -0.989531 -2.503916
H 3.607030 3.254608 0.553750
H 1.375379 3.793750 -0.373817
H -4.323954 -0.487060 -2.101859
H 4.995861 -0.042950 0.784467
H 5.225644 1.584640 1.047117
H -2.820651 1.117544 2.759236
H -5.487984 0.826068 0.999452


%chk=000194310-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194310

0 1
O -3.615964 0.961745 2.132005
O -5.414864 0.407401 0.194887
N 1.945930 -2.347288 -0.296576
N 4.585006 0.798720 1.051784
C 0.167469 -0.696831 -0.801572
C 0.527520 -2.017544 -0.069794
C 1.162422 0.410920 -0.424988
C 2.425201 0.071961 0.123608
C 2.847383 -1.373625 0.345851
C -1.300119 -0.350702 -0.552964
C 3.344893 1.110683 0.477694
C 0.836365 1.771036 -0.664242
C 2.298381 -3.735997 0.040360
C -1.720660 0.179007 0.696965
C -2.282265 -0.619848 -1.536728
C 3.003279 2.468385 0.233468
C 1.758179 2.788199 -0.341842
C -3.081674 0.428368 0.932540
C -3.654697 -0.373209 -1.296815
C -4.062224 0.151162 -0.057575
H 0.290501 -0.900936 -1.884542
H 0.284638 -1.916486 1.020388
H -0.096588 -2.837135 -0.469355
H 3.864814 -1.531253 -0.073547
H 2.927777 -1.566245 1.455780
H -0.138025 2.023270 -1.094520
H 3.345721 -3.935951 -0.252610
H 1.650129 -4.431574 -0.520979
H 2.196840 -3.970894 1.131314
H -0.971678 0.417644 1.463347
H -1.972769 -1.024946 -2.507230
H 3.714851 3.261760 0.494516
H 1.505635 3.837355 -0.533855
H -4.414240 -0.575728 -2.057507
H 4.839583 -0.152340 1.295203
H 5.239730 1.540584 1.280309
H -2.906588 1.187922 2.779498
H -5.499688 0.780813 1.111524


