%chk=000219269.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219269

0 1
O -1.776876 -1.648445 -0.778908
O 3.235389 1.142039 -0.683768
O 1.155881 -1.577816 -1.292342
O 2.177774 0.879797 1.306992
N -1.427904 0.595228 -0.281388
C -2.823485 0.953720 0.179926
C -0.289702 1.554633 -0.214693
C 0.929991 0.802206 -0.797854
C -1.053194 -0.685085 -0.671014
C 0.474061 -0.654112 -0.972056
C -3.149506 0.094136 1.410727
C -2.894950 2.445148 0.540613
C -3.787717 0.641701 -0.974530
C 2.138070 0.921405 0.101611
C 4.551971 1.189445 -0.034487
C 4.993987 -0.212462 0.320085
H -0.106404 1.862355 0.841568
H -0.516026 2.465638 -0.806717
H 1.190653 1.197844 -1.817443
H -2.442720 0.259883 2.230482
H -4.154660 0.304170 1.789324
H -3.115589 -0.980040 1.166975
H -2.653568 3.093145 -0.308424
H -2.235896 2.707511 1.375311
H -3.914090 2.707894 0.855095
H -3.750668 -0.426306 -1.247054
H -4.822885 0.866061 -0.699282
H -3.549657 1.211594 -1.877943
H 5.154627 1.650676 -0.838627
H 4.483902 1.855330 0.843423
H 6.047583 -0.239512 0.622542
H 4.401602 -0.624937 1.151038
H 4.873007 -0.900845 -0.528782


%chk=000219269-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219269

0 1
O -1.689106 -1.664819 -0.781917
O 3.293744 1.100293 -0.768328
O 1.264810 -1.464375 -1.182836
O 2.264397 1.252149 1.326785
N -1.427430 0.648219 -0.255450
C -2.854831 0.935965 0.152579
C -0.319209 1.620754 -0.055263
C 0.917094 0.976359 -0.720856
C -1.002383 -0.612881 -0.649207
C 0.516349 -0.514607 -0.895287
C -3.177613 0.090560 1.416316
C -3.024398 2.440775 0.467920
C -3.797161 0.550070 -1.019160
C 2.200071 1.136095 0.079767
C 4.648572 1.065705 -0.122756
C 5.014875 -0.368003 0.266590
H -0.119020 1.775598 1.021755
H -0.567068 2.592871 -0.510120
H 1.086956 1.371134 -1.739611
H -2.521503 0.375123 2.259074
H -4.226154 0.260754 1.720135
H -3.044480 -0.983650 1.207646
H -2.840700 3.072221 -0.420131
H -2.366814 2.776183 1.289505
H -4.067083 2.611559 0.787101
H -3.698365 -0.517781 -1.269096
H -4.843744 0.749968 -0.726638
H -3.567203 1.149371 -1.918755
H 5.311092 1.468992 -0.904507
H 4.634271 1.737491 0.753556
H 6.053675 -0.394447 0.644643
H 4.349222 -0.744449 1.060954
H 4.942137 -1.041197 -0.604008


