%chk=000187529.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187529

0 1
O 4.616016 -0.718855 -0.617082
O 5.299767 -0.402317 0.583279
C 2.216344 -0.329859 0.002564
C 0.856498 -1.041710 0.034606
C 2.452524 0.335437 1.389119
C 3.364948 -1.351092 -0.277115
C -0.374361 -0.303572 0.032423
C 2.258994 0.637826 -1.164555
C -1.609558 -1.000017 -0.008546
C 0.802925 -2.426768 0.077150
C 3.047825 1.708885 1.351508
C -2.868935 -0.264084 -0.055477
C 2.748106 1.882468 -1.063767
C -0.415068 1.143528 0.093977
C -1.613293 -2.420437 0.004560
C 3.192815 2.418842 0.221810
C -0.428221 -3.118552 0.061943
C -2.851528 1.148593 -0.022493
C -1.583085 1.833243 0.067042
C -4.125899 -0.924309 -0.136568
C -4.071726 1.875473 -0.071515
C -5.303443 -0.205203 -0.183867
C -5.277748 1.209202 -0.151273
H 3.105386 -0.325976 2.001171
H 1.495540 0.386203 1.955994
H 3.184294 -1.925085 -1.209158
H 3.521968 -2.039365 0.570052
H 1.896959 0.231777 -2.107712
H 1.705326 -3.034994 0.127375
H 3.347006 2.103543 2.322307
H 2.816980 2.545654 -1.924919
H 0.527039 1.689480 0.176881
H -2.565626 -2.952675 -0.024179
H 3.626711 3.417024 0.215841
H -0.424460 -4.207501 0.091435
H -1.593263 2.921974 0.115442
H -4.151398 -2.015203 -0.162928
H -4.040541 2.963626 -0.046069
H -6.261792 -0.717940 -0.247128
H -6.215824 1.760336 -0.189873
H 5.166897 0.595398 0.602444


%chk=000187529-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187529

0 1
O 4.720845 -0.714496 -0.424530
O 5.292003 -0.401225 0.955944
C 2.210772 -0.276870 -0.043168
C 0.850753 -1.033803 -0.070122
C 2.370670 0.434345 1.357817
C 3.390272 -1.306389 -0.248773
C -0.410877 -0.313064 -0.064835
C 2.325738 0.707427 -1.212422
C -1.663663 -1.041391 -0.048702
C 0.811801 -2.440559 -0.064598
C 3.227918 1.689633 1.346138
C -2.939830 -0.313488 -0.036498
C 2.988382 1.895875 -1.106613
C -0.469056 1.137287 -0.070541
C -1.631680 -2.468471 -0.044247
C 3.502949 2.369529 0.188324
C -0.416481 -3.154164 -0.054025
C -2.932339 1.127365 -0.038726
C -1.668674 1.820950 -0.058945
C -4.210464 -0.970578 -0.021171
C -4.164569 1.851737 -0.024439
C -5.409409 -0.244496 -0.007127
C -5.391612 1.180275 -0.008528
H 2.785750 -0.301054 2.073093
H 1.373796 0.703291 1.760383
H 3.254966 -1.854330 -1.201188
H 3.436635 -2.021827 0.594503
H 1.930072 0.369066 -2.178820
H 1.733141 -3.027563 -0.066786
H 3.551710 2.086402 2.317834
H 3.130904 2.528397 -1.990340
H 0.460354 1.707176 -0.106168
H -2.562355 -3.042021 -0.032631
H 4.086064 3.298175 0.214888
H -0.403074 -4.249451 -0.050370
H -1.675263 2.917431 -0.068071
H -4.265318 -2.062998 -0.019744
H -4.131070 2.947767 -0.026598
H -6.367056 -0.776612 0.005066
H -6.332617 1.740802 0.002485
H 5.085013 0.584918 1.006948


