%chk=000194673.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194673

0 1
O 2.364178 1.797571 0.437553
N -1.549748 0.094782 -0.246286
N 1.077869 -1.450266 -0.041979
C 0.401848 0.594057 1.318779
C 0.727964 0.827842 -1.129207
C 0.977807 1.513500 0.226638
C -1.127756 0.517613 1.127189
C -0.796816 0.762228 -1.358086
C 1.098901 -0.781166 1.297631
C 1.424579 -0.546568 -1.184818
C -3.024828 0.318696 -0.438091
C 2.006194 -2.622683 -0.031167
C -3.825479 -0.651984 0.431484
H 0.599496 1.049770 2.320756
H 1.170148 1.455651 -1.942363
H 0.536383 2.535202 0.265437
H -1.536441 -0.254057 1.820207
H -1.571715 1.492774 1.428094
H -1.164438 1.791613 -1.567777
H -0.996915 0.150733 -2.268485
H 0.559613 -1.469773 1.988640
H 2.128457 -0.659059 1.703182
H 2.520645 -0.379985 -1.286031
H 1.093273 -1.081939 -2.104791
H -3.337970 1.364947 -0.230635
H -3.261551 0.118691 -1.507564
H 2.899533 0.979651 0.434352
H 1.911434 -3.159637 -0.989016
H 1.683241 -3.324340 0.755017
H 3.066920 -2.383381 0.130252
H -3.400469 -1.665241 0.370256
H -3.822811 -0.363081 1.486896
H -4.867447 -0.706962 0.101034


%chk=000194673-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194673

0 1
O 2.462593 1.842540 0.455458
N -1.514650 0.163756 -0.237307
N 1.063783 -1.389267 -0.034061
C 0.417261 0.644563 1.322039
C 0.747875 0.871903 -1.120730
C 1.035578 1.554406 0.235978
C -1.119019 0.617547 1.112607
C -0.786915 0.845161 -1.329567
C 1.101769 -0.743766 1.291764
C 1.435771 -0.514834 -1.162298
C -2.976878 0.164585 -0.463647
C 1.768051 -2.677738 -0.057415
C -3.740508 -0.817994 0.444387
H 0.609769 1.088686 2.318203
H 1.185301 1.483986 -1.933548
H 0.567866 2.555271 0.265928
H -1.576046 -0.055065 1.861097
H -1.506412 1.654141 1.326260
H -1.125078 1.912858 -1.451246
H -1.025857 0.325581 -2.278363
H 0.606578 -1.415398 2.019895
H 2.161130 -0.617152 1.662682
H 2.552211 -0.347447 -1.209285
H 1.169026 -1.031290 -2.104859
H -3.412347 1.194903 -0.345955
H -3.142662 -0.127286 -1.519239
H 2.969673 0.990812 0.435869
H 1.611692 -3.174609 -1.032159
H 1.367262 -3.339447 0.731929
H 2.875717 -2.583429 0.105003
H -3.296508 -1.826011 0.366659
H -3.721308 -0.510594 1.505148
H -4.800617 -0.874174 0.135872


