%chk=000227889.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227889

0 1
O -2.182188 0.143461 -0.333145
O -1.935021 -1.956107 0.457855
C 4.252354 0.293827 0.098614
C 2.762970 0.001364 0.092747
C -3.651825 -0.030453 -0.385400
C -4.161903 1.412676 -0.328842
C 4.563982 1.458525 1.045925
C 4.746107 0.578485 -1.324836
C 2.301401 -1.253631 0.523071
C 1.837568 0.966916 -0.336666
C 0.016911 -0.570661 0.093963
C -3.978799 -0.746877 -1.685052
C 0.936684 -1.540441 0.524656
C 0.472123 0.684863 -0.336956
C -1.423470 -0.912154 0.109864
C -4.229254 1.939508 1.100198
H 4.799233 -0.610111 0.476183
H -3.948111 -0.632301 0.502127
H -3.491378 2.056716 -0.936905
H -5.158640 1.474762 -0.807440
H 4.109557 2.396276 0.707288
H 5.643819 1.627914 1.120676
H 4.188048 1.260304 2.056605
H 4.499975 -0.246795 -2.003377
H 5.833282 0.712433 -1.345690
H 4.297601 1.487412 -1.741074
H 3.008714 -2.010561 0.858414
H 2.188149 1.941746 -0.671462
H -3.562524 -0.224084 -2.554484
H -3.554356 -1.762167 -1.684961
H -5.059375 -0.845304 -1.833903
H 0.572403 -2.516039 0.858991
H -0.251689 1.433421 -0.670153
H -3.248527 1.877808 1.590683
H -4.939442 1.372559 1.712948
H -4.541181 2.989811 1.121839


%chk=000227889-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227889

0 1
O -2.242399 0.185439 -0.381981
O -1.942439 -1.982116 0.436510
C 4.299254 0.291244 0.143545
C 2.796802 0.003739 0.118074
C -3.730470 -0.043303 -0.449754
C -4.372796 1.340162 -0.270126
C 4.635247 1.487885 1.073866
C 4.857455 0.529394 -1.285547
C 2.290572 -1.245876 0.561617
C 1.869943 0.974877 -0.350224
C -0.005132 -0.543695 0.074595
C -4.059753 -0.717522 -1.788834
C 0.909045 -1.521531 0.541564
C 0.487418 0.710461 -0.373072
C -1.457997 -0.879033 0.072003
C -4.104998 1.965012 1.114615
H 4.804114 -0.605834 0.555332
H -3.992386 -0.715917 0.389425
H -4.001872 2.009976 -1.070283
H -5.463429 1.224302 -0.429543
H 4.169086 2.420995 0.706556
H 5.728367 1.650068 1.114261
H 4.271944 1.310379 2.101930
H 4.649616 -0.331798 -1.945521
H 5.951650 0.685196 -1.251072
H 4.403034 1.426164 -1.746193
H 2.990009 -2.008353 0.925444
H 2.233888 1.947993 -0.700572
H -3.747273 -0.079159 -2.634456
H -3.551833 -1.693088 -1.870011
H -5.148962 -0.890638 -1.866884
H 0.515736 -2.484970 0.882791
H -0.221384 1.460829 -0.734397
H -3.021013 2.090274 1.282138
H -4.502186 1.324425 1.924406
H -4.583662 2.957119 1.202097


