%chk=000192583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192583

0 1
O 2.629276 -2.842705 1.760371
O -1.036676 -4.029508 -1.210330
O 6.316530 1.789237 -1.657850
O -6.595462 -0.638823 1.053158
C 1.271304 -1.201124 0.804288
C -0.558825 -1.768338 -0.729816
C 0.215267 -0.814825 -0.038831
C 2.099233 -0.191396 1.551381
C -1.679891 -1.377916 -1.651555
C 1.556383 -2.581833 0.937095
C -0.244444 -3.126226 -0.537463
C 0.806543 -3.562380 0.281362
C 3.199385 0.368497 0.688200
C -2.982613 -1.195527 -0.917031
C -0.052734 0.627077 -0.223840
C 4.303092 -0.444906 0.361854
C 3.140224 1.682058 0.209341
C -3.594902 -2.296148 -0.297146
C -3.598557 0.066024 -0.862339
C -0.906015 1.319331 0.538781
C 5.339025 0.044606 -0.425021
C 4.169461 2.201117 -0.583717
C -4.808604 -2.151984 0.377120
C -4.812563 0.237290 -0.199446
C -1.125102 2.768194 0.396983
C 5.254224 1.370568 -0.886606
C -5.398793 -0.880922 0.413480
C 2.970188 -4.226450 2.019973
C -0.040314 3.644610 0.228538
C -2.431246 3.284168 0.452047
C -0.261317 5.018151 0.104119
C -2.645685 4.657830 0.321783
C -1.563144 5.526957 0.146652
H 2.542859 -0.664222 2.458830
H 1.448046 0.618822 1.943454
H -1.809516 -2.163035 -2.433928
H -1.407192 -0.457269 -2.209862
H 1.020883 -4.615941 0.391455
H 0.529048 1.085695 -1.029522
H 4.332543 -1.473187 0.732303
H 2.279922 2.318419 0.449077
H -3.110457 -3.274884 -0.345756
H -3.123425 0.923800 -1.340876
H -1.498960 0.831606 1.319469
H -0.728111 -4.959531 -1.079949
H 6.200048 -0.563797 -0.689535
H 4.121868 3.219861 -0.950870
H -5.278549 -3.003037 0.856609
H -5.311334 1.201540 -0.152700
H 3.269934 -4.723216 1.092886
H 2.137128 -4.738603 2.509637
H 3.822942 -4.120644 2.703799
H 0.980161 3.247886 0.206274
H -3.276069 2.610674 0.595515
H 0.582390 5.693906 -0.025053
H -3.659536 5.053799 0.359321
H -1.734245 6.596731 0.047063
H 6.209731 2.722840 -1.958104
H -6.966662 -1.455917 1.462429


%chk=000192583-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000192583

0 1
O 2.777091 -3.158035 1.677811
O -1.187928 -4.017906 -1.124267
O 6.360981 2.301316 -1.524722
O -7.023306 -0.765612 0.859224
C 1.424239 -1.346973 0.878275
C -0.589491 -1.760528 -0.537989
C 0.297436 -0.856392 0.139514
C 2.351735 -0.408711 1.647431
C -1.736784 -1.317994 -1.437529
C 1.649162 -2.747451 0.937156
C -0.311726 -3.145789 -0.436316
C 0.784805 -3.657371 0.289773
C 3.387589 0.330617 0.793617
C -3.116266 -1.185660 -0.779957
C 0.141797 0.615868 0.066535
C 4.148700 -0.350594 -0.193407
C 3.641298 1.709585 0.995233
C -3.517677 -1.998379 0.307644
C -4.053827 -0.247617 -1.289298
C -1.024175 1.329796 0.134466
C 5.129456 0.316342 -0.952570
C 4.623348 2.395567 0.243946
C -4.806709 -1.881310 0.874031
C -5.345968 -0.119156 -0.740732
C -1.152980 2.797995 0.062263
C 5.366806 1.692877 -0.732533
C -5.721782 -0.940292 0.346129
C 3.027974 -4.592844 1.807102
C -0.053860 3.676343 -0.173287
C -2.444775 3.374488 0.235432
C -0.243997 5.071157 -0.224343
C -2.635036 4.771542 0.184309
C -1.534187 5.628797 -0.044493
H 2.887364 -1.009816 2.404432
H 1.745720 0.334495 2.198461
H -1.827679 -2.061955 -2.252488
H -1.477680 -0.351685 -1.907024
H 0.955242 -4.738580 0.338272
H 1.088481 1.166101 -0.015458
H 3.966592 -1.416889 -0.366061
H 3.069174 2.258264 1.754107
H -2.815660 -2.730155 0.718995
H -3.766246 0.398514 -2.128377
H -1.966517 0.788866 0.287646
H -0.871435 -4.952649 -1.062198
H 5.717716 -0.205434 -1.713588
H 4.804380 3.464544 0.419283
H -5.094408 -2.520212 1.720089
H -6.066535 0.603800 -1.135021
H 3.217151 -5.061664 0.821344
H 2.184265 -5.107149 2.307962
H 3.930928 -4.671374 2.430350
H 0.951425 3.267297 -0.325911
H -3.301845 2.712137 0.411361
H 0.612634 5.729802 -0.408837
H -3.638269 5.190515 0.321619
H -1.677047 6.714370 -0.086120
H 6.453466 3.259128 -1.295276
H -7.186466 -1.386947 1.611493


