%chk=000228448.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228448

0 1
O -1.869849 2.596241 -1.525603
O -2.978886 -0.376148 -0.601532
O 1.016492 0.508987 1.612849
O -1.525905 2.006985 0.638451
O -1.708740 -1.636319 -1.999067
O 3.834185 0.095918 -1.362869
O -0.381752 -1.264411 1.317451
O 3.019083 -1.408355 0.125782
C -0.874431 0.520494 -1.236795
C 0.396711 0.038164 -0.583917
C -1.448803 1.747532 -0.533276
C -1.863687 -0.644746 -1.333699
C 1.535052 -0.068073 -1.276119
C 0.268534 -0.353528 0.868443
C -2.477368 3.872278 -1.131022
C -3.916587 -1.486798 -0.352910
C 2.818823 -0.567116 -0.715764
C 0.929666 0.402214 3.077539
C -1.400004 4.841787 -0.697982
C -3.486174 -2.172245 0.922851
C -0.421927 0.900413 3.537055
C 5.213378 -0.247883 -1.004852
C 5.597560 -1.565683 -1.641768
H -0.659577 0.823932 -2.310149
H 1.600994 0.208629 -2.337562
H -3.220583 3.673099 -0.338727
H -2.974087 4.159045 -2.076482
H -3.920095 -2.157141 -1.230963
H -4.871802 -0.939616 -0.266232
H 1.130411 -0.646181 3.357829
H 1.768371 1.060133 3.369490
H -0.925839 4.519803 0.242134
H -0.603393 4.926400 -1.448650
H -1.807895 5.846254 -0.531198
H -2.407997 -2.419578 0.903921
H -3.624573 -1.529825 1.802370
H -4.034170 -3.105780 1.090213
H -0.761035 1.749541 2.917494
H -1.195725 0.125498 3.434395
H -0.406405 1.228755 4.580680
H 5.294305 -0.265452 0.096528
H 5.753531 0.619127 -1.427869
H 5.042038 -2.403251 -1.191323
H 5.379890 -1.575542 -2.717569
H 6.666164 -1.776558 -1.515178


%chk=000228448-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228448

0 1
O -2.127082 2.638656 -1.462413
O -2.863395 -0.328386 -0.695158
O 1.176745 0.711151 1.806914
O -1.434643 2.163779 0.717686
O -1.354517 -1.510017 -2.030320
O 4.008657 -0.133967 -1.525482
O -0.417883 -0.944323 1.373506
O 3.136165 -1.007076 0.464043
C -0.733225 0.725601 -1.185211
C 0.545965 0.309614 -0.465654
C -1.449957 1.895594 -0.501929
C -1.664354 -0.509618 -1.352095
C 1.709721 0.173406 -1.159790
C 0.384624 -0.057643 0.989386
C -2.934138 3.797767 -0.962333
C -3.807954 -1.496444 -0.681625
C 2.973428 -0.382808 -0.611708
C 1.079746 0.441979 3.277665
C -2.064831 5.052847 -0.852532
C -3.459126 -2.441670 0.469446
C -0.069751 1.248090 3.887866
C 5.354268 -0.673273 -1.160571
C 5.490538 -2.133579 -1.602350
H -0.479922 1.033469 -2.214526
H 1.745905 0.437127 -2.222354
H -3.371274 3.520732 0.012816
H -3.726483 3.904028 -1.720089
H -3.747352 -2.001335 -1.661842
H -4.794317 -1.022794 -0.554757
H 0.943893 -0.643626 3.423768
H 2.064559 0.755619 3.658116
H -1.280583 4.920831 -0.088657
H -1.588159 5.288821 -1.819530
H -2.692270 5.914438 -0.557715
H -2.457269 -2.878861 0.331473
H -3.470617 -1.907878 1.434048
H -4.201301 -3.260968 0.507929
H 0.054634 2.324950 3.684387
H -1.037396 0.926907 3.469887
H -0.086810 1.094934 4.983214
H 5.489724 -0.570453 -0.069377
H 6.052127 -0.010383 -1.696546
H 4.788332 -2.777821 -1.047605
H 5.295184 -2.238006 -2.683478
H 6.518290 -2.488412 -1.400108


