%chk=000191640.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191640

0 1
O 3.367508 0.084520 -1.569888
O 2.382031 1.432239 0.064049
O 4.527585 -0.525207 2.349308
O 3.138429 -2.635704 0.937887
O 5.920775 1.076486 -0.127898
O -4.332740 -1.997446 1.936238
O -4.543514 0.438088 -1.970952
O 1.458203 -2.044860 -2.737527
O -2.163974 3.500753 -0.979114
C 4.523190 -0.638551 0.920412
C 3.192485 -1.289594 0.479254
C 4.635452 0.819408 0.422862
C 2.987326 -1.207840 -1.043346
C 3.573574 1.160597 -0.653444
C -4.740280 -1.445255 -0.431449
C -3.730657 -1.958404 0.636094
C -2.644035 -0.901351 0.694967
C -2.834823 0.087271 -0.295790
C -1.926899 1.136435 -0.439507
C -0.811547 1.191495 0.428773
C -4.088613 -0.192611 -1.048334
C 0.195388 2.299411 0.278129
C -0.642213 0.209475 1.430119
C -1.567820 -0.847790 1.560261
C 1.521025 -1.456650 -1.437251
C 1.280866 1.961845 -0.738989
C -5.067534 -2.475152 -1.498063
C -2.146798 2.170369 -1.520035
C 0.517895 0.254480 2.365982
H 5.408343 -1.238738 0.615780
H 2.337983 -0.799337 1.038436
H 4.578736 1.526831 1.292890
H 3.658732 -1.905168 -1.598410
H 3.873803 1.986883 -1.333501
H -5.677609 -1.117044 0.085182
H -3.323761 -2.963729 0.396821
H 0.673124 2.546051 1.252951
H -0.318862 3.246956 -0.021800
H -1.446819 -1.599472 2.339916
H 0.935430 -0.512291 -1.416798
H 1.041545 -2.218737 -0.790168
H 0.983282 1.166293 -1.452841
H 1.638750 2.851902 -1.282518
H -5.610687 -3.331709 -1.083727
H -5.701241 -2.033113 -2.283447
H -4.167973 -2.857893 -1.996857
H -1.302701 2.199328 -2.236969
H -3.090162 2.003321 -2.086330
H 4.277317 -1.390859 2.753645
H 3.749914 -3.216845 0.435737
H 6.083139 0.522750 -0.925366
H 0.530685 1.183984 2.955508
H 0.529943 -0.576489 3.082769
H 1.481761 0.227178 1.808439
H -5.020597 -2.693352 1.969664
H 1.786529 -1.409823 -3.411370
H -2.944385 3.611762 -0.393983


%chk=000191640-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191640

0 1
O 3.233593 0.126921 -1.642204
O 2.305443 1.438732 0.199825
O 3.694357 -0.852938 2.420155
O 2.346460 -2.844338 0.603121
O 5.756560 0.220016 -0.234572
O -3.802390 -2.318506 2.055629
O -4.021746 -0.094451 -2.264609
O 1.466078 -1.197434 -3.392448
O -2.352755 3.434058 -1.298545
C 3.930632 -0.978769 0.979510
C 2.639879 -1.434427 0.268639
C 4.472208 0.382453 0.462077
C 2.701841 -1.233126 -1.259602
C 3.492142 1.056595 -0.513720
C -4.255294 -1.698518 -0.378500
C -3.223461 -2.060529 0.728024
C -2.318836 -0.843975 0.806060
C -2.487325 0.007068 -0.315918
C -1.681632 1.169169 -0.479808
C -0.709724 1.469856 0.521160
C -3.611430 -0.515336 -1.145967
C 0.197358 2.683879 0.340224
C -0.589460 0.637757 1.687299
C -1.393775 -0.526614 1.808981
C 1.336936 -1.379955 -1.946423
C 1.439817 2.403223 -0.522517
C -4.707263 -2.842711 -1.302153
C -1.885541 2.078261 -1.689167
C 0.378472 0.974184 2.807512
H 4.728172 -1.733440 0.785190
H 1.785555 -0.883143 0.690461
H 4.677080 1.030559 1.326796
H 3.414923 -1.952202 -1.716650
H 3.967359 1.920112 -1.019490
H -5.136796 -1.270613 0.145045
H -2.632460 -2.946139 0.401611
H 0.541028 3.065266 1.316860
H -0.371799 3.497425 -0.145097
H -1.304706 -1.165990 2.692744
H 0.622329 -0.653491 -1.504713
H 0.945747 -2.400176 -1.802300
H 1.166871 1.974239 -1.506600
H 2.012332 3.339837 -0.686498
H -5.278305 -3.609137 -0.746096
H -5.350849 -2.447127 -2.106619
H -3.839982 -3.335457 -1.779143
H -0.934525 2.275111 -2.210198
H -2.589968 1.615592 -2.400259
H 3.239135 -1.680920 2.725320
H 3.075524 -3.419150 0.248780
H 5.560510 -0.085443 -1.160719
H 0.150439 1.962856 3.250410
H 0.315178 0.226670 3.615581
H 1.422474 1.009990 2.449526
H -4.266474 -3.193198 2.039715
H 1.948353 -0.341205 -3.535338
H -3.273786 3.353722 -0.943981


