%chk=000223401.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223401

0 1
O 3.751068 -2.720277 0.835133
O -4.915890 2.862381 0.982247
O 4.911089 -2.879631 -0.980800
O -3.755669 2.703611 -0.833613
O 8.788181 1.935304 -0.400510
O -8.791770 -1.953395 0.400791
O 8.932554 -0.121883 -1.063029
O -8.936714 0.103649 1.063628
N 4.528183 -2.279270 0.007540
N -4.532766 2.262292 -0.006174
N 8.340142 0.812620 -0.554880
N -8.344036 -0.830616 0.555353
C 0.491050 -0.108671 0.579748
C -0.495051 0.093036 -0.578509
C 1.935046 0.138997 0.125151
C -1.938995 -0.155164 -0.124039
C 2.920442 -0.066030 1.288303
C -2.924397 0.049728 -1.287223
C 4.332727 0.115552 0.824374
C -4.336664 -0.132325 -0.823415
C 5.076569 -0.915904 0.208666
C -5.080810 0.898833 -0.207580
C 4.945299 1.376874 0.974920
C -4.948916 -1.393769 -0.974250
C 6.382853 -0.693791 -0.256549
C -6.387080 0.676324 0.257478
C 6.242131 1.609476 0.536296
C -6.245733 -1.626770 -0.535772
C 6.959152 0.566170 -0.082218
C -6.963061 -0.583751 0.082868
H 0.234371 0.570100 1.416730
H 0.394762 -1.136866 0.983288
H -0.238147 -0.585423 -1.415670
H -0.399038 1.121375 -0.981755
H 2.036421 1.165928 -0.278522
H 2.187238 -0.545170 -0.709587
H -2.040068 -1.182189 0.279473
H -2.191432 0.528798 0.710794
H 2.680649 0.636625 2.114278
H 2.774606 -1.080475 1.735023
H -2.778858 1.064287 -1.733787
H -2.684334 -0.652736 -2.113282
H 4.383508 2.188496 1.445438
H -4.386894 -2.205170 -1.444878
H 6.946107 -1.500824 -0.755750
H -6.950575 1.483127 0.756780
H 6.717125 2.592199 0.660096
H -6.720477 -2.609584 -0.659802


%chk=000223401-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223401

0 1
O 3.588641 -2.630261 0.573859
O -5.159213 2.896428 1.050781
O 5.155408 -2.914573 -1.047417
O -3.593742 2.614669 -0.572128
O 9.025522 1.936403 -0.281589
O -9.029287 -1.953743 0.282122
O 9.085479 -0.191086 -1.107894
O -9.089312 0.173408 1.109295
N 4.591642 -2.213968 -0.122987
N -4.596016 2.197131 0.125015
N 8.491288 0.784347 -0.510673
N -8.495138 -0.801717 0.511551
C 0.506777 -0.043078 0.580738
C -0.510744 0.026415 -0.580023
C 1.966681 0.100895 0.098599
C -1.970641 -0.117563 -0.097876
C 2.972797 0.046910 1.288125
C -2.976791 -0.063454 -1.287374
C 4.417360 0.157922 0.836796
C -4.421366 -0.174458 -0.836059
C 5.156414 -0.857993 0.155025
C -5.160463 0.841171 -0.153803
C 5.096994 1.391951 1.040056
C -5.100967 -1.408425 -1.039772
C 6.479206 -0.665576 -0.295200
C -6.483164 0.648417 0.296527
C 6.417302 1.616242 0.614559
C -6.421231 -1.632969 -0.614283
C 7.093429 0.572213 -0.052521
C -7.097345 -0.589292 0.053341
H 0.278431 0.754744 1.317544
H 0.395529 -1.008926 1.114269
H -0.282399 -0.771400 -1.316838
H -0.399500 0.992268 -1.113544
H 2.091600 1.057578 -0.446676
H 2.192758 -0.712352 -0.617169
H -2.095571 -1.074289 0.447320
H -2.196662 0.695625 0.617971
H 2.751917 0.886893 1.972614
H 2.809564 -0.894438 1.836873
H -2.813526 0.877868 -1.836128
H -2.755960 -0.903451 -1.971865
H 4.557654 2.195454 1.552190
H -4.561612 -2.211704 -1.552241
H 7.012017 -1.462264 -0.820006
H -7.015981 1.444812 0.821773
H 6.927101 2.567885 0.785654
H -6.930984 -2.584573 -0.785729


