%chk=000228767.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228767

0 1
O -0.979280 0.730072 0.005647
O -2.046521 2.716420 0.012848
O -6.876038 -1.469836 0.013248
C 5.231215 0.358159 -0.005321
C 3.806749 -0.212779 -0.005442
C 6.282709 -0.759688 -0.010669
C 2.756287 0.905895 -0.000157
C 7.707105 -0.188996 -0.010812
C 1.335115 0.331936 -0.000075
C 8.760452 -1.305865 -0.016657
C 0.299910 1.450886 0.004573
C 10.180145 -0.743296 -0.016533
C -2.121175 1.505968 0.010056
C -3.328363 0.663117 0.010650
C -4.587083 1.304105 0.015048
C -3.250770 -0.737551 0.006992
C -5.752452 0.555057 0.015781
C -4.411309 -1.511682 0.007651
C -5.651833 -0.855771 0.012047
C -6.917082 -2.919395 0.009723
H 5.375062 1.013476 -0.886119
H 5.377419 1.007223 0.879713
H 3.661755 -0.862059 -0.890631
H 3.664079 -0.868225 0.875575
H 6.137608 -1.408857 -0.895660
H 6.140205 -1.414843 0.870331
H 2.900624 1.560565 -0.882157
H 2.903128 1.554570 0.885852
H 7.854459 0.460103 0.873685
H 7.851663 0.466693 -0.890889
H 1.176186 -0.319514 -0.883056
H 1.178398 -0.324717 0.879453
H 8.616012 -1.954766 -0.902578
H 8.618569 -1.961606 0.864635
H 0.328814 2.086986 -0.896057
H 0.332605 2.083003 0.907878
H 10.924704 -1.547126 -0.021053
H 10.369615 -0.125693 0.868767
H 10.366858 -0.118331 -0.897242
H -4.627608 2.398672 0.017859
H -2.268381 -1.220802 0.003601
H -6.735535 1.021631 0.019131
H -4.340755 -2.593811 0.004801
H -6.451366 -3.309859 -0.899595
H -6.447348 -3.314381 0.915013
H -7.998752 -3.110788 0.011641


%chk=000228767-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228767

0 1
O -1.027722 0.551857 -0.000490
O -2.065051 2.638048 -0.113032
O -7.173567 -1.334609 0.021051
C 5.330314 0.327393 0.034967
C 3.910186 -0.273241 -0.065734
C 6.451074 -0.730259 -0.080313
C 2.791943 0.789027 0.025601
C 7.871389 -0.133411 0.041035
C 1.373901 0.173802 -0.032506
C 8.992814 -1.190270 -0.081320
C 0.289508 1.250315 0.003950
C 10.407935 -0.585688 0.045903
C -2.155079 1.383948 -0.056196
C -3.425320 0.614489 -0.037583
C -4.650958 1.334462 -0.107349
C -3.457936 -0.799414 0.052380
C -5.877881 0.657885 -0.087374
C -4.685295 -1.492017 0.075181
C -5.899570 -0.759605 0.005485
C -7.266196 -2.794957 0.123578
H 5.463655 1.090255 -0.760575
H 5.432763 0.865361 1.000698
H 3.812106 -0.826089 -1.023245
H 3.771694 -1.022537 0.741548
H 6.357470 -1.258507 -1.052408
H 6.310163 -1.501097 0.706373
H 2.915383 1.520170 -0.800499
H 2.908390 1.362237 0.968876
H 7.968120 0.389615 1.015661
H 8.012924 0.641344 -0.741615
H 1.260299 -0.425368 -0.956675
H 1.229976 -0.517459 0.820373
H 8.897598 -1.710735 -1.056284
H 8.849176 -1.965281 0.699368
H 0.336014 1.922913 -0.872700
H 0.350496 1.874126 0.915805
H 11.190740 -1.361697 -0.040715
H 10.537050 -0.082823 1.023099
H 10.589699 0.167503 -0.744021
H -4.612405 2.426428 -0.175659
H -2.514353 -1.349614 0.105534
H -6.829951 1.193843 -0.140439
H -4.687027 -2.583481 0.146420
H -6.781670 -3.289171 -0.740298
H -6.813211 -3.159995 1.065315
H -8.343791 -3.013396 0.120324


