%chk=000184907.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184907

0 1
O 3.483035 0.174478 0.740304
O -0.842532 0.395292 1.028860
O 4.621479 1.982540 -0.036543
O 2.974334 1.624162 -2.464011
O 0.357441 0.689324 -0.856336
C 3.489220 -1.037439 -0.112858
C 3.342973 1.363056 -0.040023
C 2.699645 -2.057805 0.707501
C 2.933249 -0.597636 -1.466337
C 1.849556 -3.053372 -0.090380
C 3.060715 0.907604 -1.511648
C 0.408515 -2.567803 -0.317124
C 2.303414 2.307781 0.568349
C -0.342592 -2.390260 1.008319
C -1.827248 -0.422366 0.281656
C -1.763924 -1.838223 0.861001
C -3.155187 0.297353 0.531571
C 1.164201 1.586937 1.283281
C -4.275856 -0.255964 -0.355189
C 0.239877 0.875310 0.336484
C -5.589278 0.504723 -0.128617
C -6.716621 -0.047404 -1.012474
C -8.026005 0.706288 -0.791496
H 4.561908 -1.317485 -0.191116
H 2.048156 -1.499824 1.422714
H 3.407607 -2.613767 1.354553
H 1.844611 -0.848983 -1.577198
H 3.438931 -1.079176 -2.319929
H 1.829013 -4.021087 0.450603
H 2.324834 -3.275423 -1.065078
H 0.429881 -1.606289 -0.880984
H -0.128294 -3.284819 -0.965639
H 1.912665 2.967181 -0.239816
H 2.817465 2.990487 1.279274
H -0.389704 -3.361647 1.539495
H 0.239471 -1.712108 1.672104
H -1.544503 -0.407900 -0.796985
H -2.370708 -2.507828 0.218811
H -2.250019 -1.854877 1.858652
H -3.016068 1.381845 0.340359
H -3.433592 0.229423 1.601358
H 0.584664 2.299151 1.909996
H 1.584172 0.836904 1.999024
H -3.983055 -0.187246 -1.421825
H -4.427001 -1.333345 -0.149219
H 5.159782 1.638676 0.713732
H -5.884112 0.444030 0.936671
H -5.443540 1.582293 -0.338089
H -6.424750 0.017033 -2.079280
H -6.866415 -1.124869 -0.804307
H -8.365456 0.632095 0.247870
H -8.824817 0.306570 -1.426430
H -7.923637 1.771912 -1.027019


%chk=000184907-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184907

0 1
O 2.861868 -0.070152 0.752772
O -0.858126 0.692905 1.104832
O 4.743053 1.393487 0.395226
O 3.359914 1.668431 -2.320709
O 0.314643 1.059643 -0.885819
C 3.463387 -1.195584 -0.075857
C 3.310620 1.168091 0.124181
C 2.847983 -2.539329 0.361000
C 3.286413 -0.697091 -1.525645
C 1.649594 -3.121185 -0.434093
C 3.322507 0.830618 -1.401899
C 0.307787 -2.350454 -0.376911
C 2.452395 2.373631 0.556994
C -0.267104 -2.187357 1.049861
C -1.845430 -0.220150 0.419525
C -1.702655 -1.605540 1.080714
C -3.230462 0.428645 0.576742
C 1.118534 2.024438 1.240437
C -4.348616 -0.320289 -0.187179
C 0.183314 1.225041 0.351580
C -5.692745 0.442177 -0.163382
C -6.822907 -0.292032 -0.920087
C -8.159127 0.481348 -0.902115
H 4.542885 -1.196128 0.173238
H 2.585279 -2.436933 1.431843
H 3.659660 -3.293006 0.322360
H 2.299247 -0.975429 -1.934170
H 4.063032 -1.050737 -2.223806
H 1.477638 -4.147805 -0.048135
H 1.947780 -3.246061 -1.495303
H 0.421399 -1.354918 -0.842151
H -0.428113 -2.902789 -0.999279
H 2.277823 2.986176 -0.346382
H 3.046526 2.996918 1.251654
H -0.281470 -3.176743 1.551933
H 0.398024 -1.536626 1.647307
H -1.563681 -0.259398 -0.649594
H -2.391572 -2.298526 0.556832
H -2.052123 -1.533401 2.130053
H -3.170816 1.468477 0.198984
H -3.485334 0.491488 1.653336
H 0.597332 2.957920 1.530854
H 1.277921 1.448709 2.167528
H -4.037096 -0.472959 -1.241972
H -4.497428 -1.329420 0.246852
H 4.854271 1.527987 1.372984
H -6.004257 0.608695 0.889071
H -5.549889 1.449070 -0.608144
H -6.506704 -0.462099 -1.969575
H -6.969539 -1.296577 -0.472875
H -8.512207 0.639016 0.134599
H -8.950307 -0.063345 -1.449339
H -8.047220 1.476655 -1.372276


