%chk=000279990.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279990

0 1
O 4.460231 1.564089 0.947080
O 5.692500 -0.560723 -0.360958
O -2.243230 1.191945 -0.374687
O -3.002483 -0.993515 1.001971
O -0.984535 2.818280 -1.388361
O -3.626348 -1.893262 -1.003675
N 2.414704 -0.404276 -0.389112
C 2.903709 0.925786 -0.845730
C 3.438377 -1.166834 0.388898
C 1.060144 -0.513832 0.016431
C 3.236337 1.911739 0.284413
C 4.635856 -1.528051 -0.503334
C 0.123337 0.484919 -0.348199
C 0.600472 -1.677636 0.683406
C -1.223736 0.299042 -0.065468
C -0.751314 -1.853444 0.962107
C -1.668561 -0.863556 0.602825
C -2.058758 2.402301 -1.047970
C -3.927588 -1.517020 0.097071
C -3.410951 2.998659 -1.215366
C -5.254080 -1.511622 0.775037
H 2.148109 1.373276 -1.535713
H 3.816372 0.751472 -1.467099
H 2.979819 -2.101159 0.790066
H 3.790765 -0.571972 1.270070
H 0.449435 1.391079 -0.867777
H 3.340657 2.942044 -0.104504
H 2.489846 1.902991 1.101094
H 5.033225 -2.529044 -0.262573
H 4.398736 -1.481074 -1.585338
H 1.306196 -2.457890 0.967658
H -1.105973 -2.752911 1.466465
H 5.129040 1.252851 0.280180
H 6.100469 -0.632782 0.529174
H -3.715307 2.977326 -2.275434
H -3.417469 4.051988 -0.891899
H -4.185278 2.461309 -0.641567
H -5.210619 -1.061082 1.780428
H -5.638768 -2.537787 0.884359
H -5.990840 -0.947225 0.183333


%chk=000279990-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279990

0 1
O 4.163999 1.563778 1.352281
O 5.753879 -0.296276 0.023639
O -2.182357 1.241547 -0.155504
O -2.951638 -1.137733 1.110023
O -1.382820 1.999612 -2.239906
O -3.826442 -0.952385 -1.065699
N 2.507275 -0.346817 -0.321732
C 2.980142 0.981018 -0.763080
C 3.469171 -1.398209 0.068887
C 1.161652 -0.521087 0.056241
C 3.170202 2.009303 0.378959
C 4.857943 -1.315336 -0.582915
C 0.178260 0.471889 -0.248902
C 0.720145 -1.700682 0.737756
C -1.174265 0.259814 0.060365
C -0.640816 -1.894385 1.040985
C -1.601103 -0.931658 0.693837
C -2.262046 1.993286 -1.359623
C -4.002474 -1.090157 0.159004
C -3.570584 2.746075 -1.375612
C -5.324402 -1.222725 0.881132
H 2.284940 1.386179 -1.521857
H 3.946761 0.858253 -1.279596
H 3.047373 -2.375045 -0.247578
H 3.594263 -1.438875 1.175208
H 0.446914 1.402463 -0.745362
H 3.464260 2.982559 -0.075133
H 2.231094 2.155330 0.939881
H 5.336873 -2.310133 -0.502482
H 4.786966 -1.058611 -1.652338
H 1.427980 -2.470384 1.050803
H -0.969714 -2.798340 1.562904
H 4.870957 1.051081 0.858232
H 6.273755 -0.707890 0.756735
H -4.383747 2.032110 -1.600682
H -3.545800 3.523725 -2.152717
H -3.777718 3.191167 -0.388862
H -5.290173 -2.057654 1.600225
H -6.132717 -1.379065 0.152370
H -5.523488 -0.301346 1.457415


