%chk=000282295.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282295

0 1
O -2.794001 1.113057 0.040093
O -4.175156 -0.504024 -0.832528
O -1.736333 -1.846508 0.893184
O 0.398168 1.797037 -1.190262
O 2.136195 2.315982 0.164891
O 4.735636 -0.520629 0.572744
O 4.282556 -0.042184 -1.600786
N 0.871431 -2.081319 0.465781
N 2.198803 -2.100663 0.192691
C -1.912412 0.123000 -0.496515
C -2.844406 -0.981006 -1.071647
C -1.119497 -0.554540 0.645217
C -4.151184 0.583637 0.137234
C -2.554613 -2.241150 -0.244981
C 0.321697 -0.804506 0.331814
C -4.408154 0.055506 1.532427
C -5.094234 1.656478 -0.357106
C 1.381913 0.034206 -0.044957
C 2.537618 -0.818419 -0.119687
C 1.396615 1.478757 -0.290539
C 3.911308 -0.415637 -0.515902
C 0.228576 3.203474 -1.520457
C 6.120339 -0.118154 0.370518
H -1.275622 0.666949 -1.230537
H -2.791010 -1.134810 -2.165353
H -1.231751 -0.002854 1.611941
H -3.464078 -2.674609 0.209278
H -1.992026 -3.006350 -0.800887
H -4.332576 0.853228 2.281476
H -5.406267 -0.392299 1.611938
H -3.680596 -0.722809 1.811007
H -4.830358 1.970395 -1.377847
H -6.130327 1.295850 -0.384474
H -5.053273 2.548738 0.280407
H 0.371795 -2.921201 0.748723
H -0.132725 3.177153 -2.553510
H 1.179468 3.744248 -1.438752
H -0.518942 3.610483 -0.832307
H 6.156848 0.961704 0.193407
H 6.552401 -0.669338 -0.470547
H 6.582773 -0.393074 1.324914


%chk=000282295-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282295

0 1
O -2.898397 1.111919 -0.424190
O -4.221228 -0.795864 -0.819689
O -1.763938 -1.624977 1.124818
O 0.139815 2.076337 -0.433625
O 2.464890 2.276584 -0.591171
O 4.895670 -0.694223 0.500988
O 4.251737 -0.133470 -1.670333
N 0.874942 -1.872295 0.693486
N 2.241882 -1.973866 0.471062
C -1.947086 0.024582 -0.666923
C -2.827813 -1.225052 -1.016627
C -1.133349 -0.380311 0.606848
C -4.235327 0.524921 -0.127833
C -2.375118 -2.322116 -0.039505
C 0.339727 -0.646156 0.373532
C -4.437228 0.339022 1.383676
C -5.290260 1.402428 -0.794296
C 1.431163 0.132226 -0.083203
C 2.574950 -0.740228 -0.011573
C 1.449863 1.567175 -0.403369
C 3.960263 -0.478503 -0.504501
C 0.009399 3.526813 -0.702139
C 6.310594 -0.495785 0.097143
H -1.286441 0.359143 -1.476790
H -2.736677 -1.542462 -2.068596
H -1.261986 0.402443 1.373362
H -3.217389 -2.917869 0.342827
H -1.627122 -2.985057 -0.522409
H -4.377709 1.316824 1.892809
H -5.432916 -0.097944 1.574270
H -3.672835 -0.335792 1.804368
H -5.072628 1.496423 -1.869885
H -6.289424 0.952634 -0.667461
H -5.293374 2.406565 -0.337064
H 0.360174 -2.643325 1.119714
H -1.074889 3.703888 -0.719766
H 0.475087 3.779134 -1.669470
H 0.499328 4.106808 0.098178
H 6.457529 0.534062 -0.268720
H 6.581685 -1.208254 -0.699992
H 6.889036 -0.682583 1.012151


