%chk=000189898.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189898

0 1
O 1.928675 0.914074 -0.797904
O 2.549397 1.832020 2.216328
O 4.072419 -0.029168 1.497622
O 2.610608 -1.512342 -2.501099
N -0.248596 0.879154 0.109950
N -2.418432 0.835198 -0.690125
N -0.256800 -1.359825 1.262330
N -2.416117 -2.502453 1.089045
N -4.268900 -1.588399 -0.062268
C 1.133840 1.358899 0.307092
C 1.798463 0.802652 1.600236
C 2.730590 -0.339187 1.100004
C 2.738647 -0.246213 -0.439755
C 2.159535 -1.478500 -1.144900
C -0.808294 -0.338134 0.525714
C -1.283300 1.546799 -0.659985
C -2.159565 -0.340566 0.034489
C -1.039455 2.833478 -1.308022
C -2.968146 -1.475072 0.343555
C -1.118035 -2.389863 1.500094
C -2.006404 3.733737 -1.493069
H 1.156785 2.475320 0.245834
H 1.073177 0.490667 2.384020
H 2.431708 -1.332132 1.493058
H 3.751169 0.011563 -0.836097
H 1.054708 -1.489557 -1.118097
H 2.556550 -2.423429 -0.725032
H 3.425522 1.950305 1.750190
H 4.177506 -0.167971 2.467975
H 2.249553 -0.740086 -2.992045
H -0.014087 2.995882 -1.656167
H -0.726001 -3.236467 2.090764
H -1.842068 4.681560 -1.989654
H -3.031056 3.583192 -1.167279
H -4.692091 -0.863692 -0.622599
H -4.810905 -2.408343 0.162598


%chk=000189898-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189898

0 1
O 1.793613 0.618325 -0.972644
O 2.657628 1.990425 1.785893
O 3.934789 -0.332095 1.783335
O 3.101773 -1.273899 -2.663067
N -0.364444 0.872709 0.069360
N -2.597316 0.963438 -0.491713
N -0.341560 -1.386004 1.137337
N -2.570293 -2.428315 1.143186
N -4.475388 -1.374992 0.221770
C 1.051103 1.253517 0.134608
C 1.782669 0.872975 1.444622
C 2.644640 -0.373990 1.070554
C 2.914886 -0.212689 -0.438095
C 2.915199 -1.520823 -1.232976
C -0.936424 -0.329679 0.507099
C -1.412457 1.619032 -0.550137
C -2.311774 -0.238792 0.159446
C -1.202975 2.921883 -1.175783
C -3.138127 -1.349461 0.505564
C -1.232839 -2.387069 1.416785
C -2.219310 3.671570 -1.685555
H 1.115007 2.346755 0.019173
H 1.080832 0.664858 2.272109
H 2.070950 -1.290767 1.289067
H 3.860528 0.339812 -0.596136
H 1.967424 -2.067163 -1.038084
H 3.770005 -2.147445 -0.925734
H 3.534866 1.584663 2.043770
H 3.899853 -0.918836 2.578542
H 2.405468 -0.624713 -2.942804
H -0.173692 3.289947 -1.247005
H -0.825695 -3.268461 1.921400
H -2.024624 4.637829 -2.161386
H -3.254894 3.319831 -1.634383
H -4.907120 -0.586450 -0.255734
H -5.021701 -2.192824 0.484418


