%chk=000184530.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184530

0 1
O 1.132197 -2.411989 -1.116167
O -1.396213 2.411945 -0.122258
O 4.839714 0.024416 -0.630954
O -4.935823 -0.194306 0.655684
O 3.506971 -1.734937 -0.006745
O -3.459210 1.442091 1.274392
N 1.338309 2.439120 -0.558345
N -1.682434 -2.404996 -0.789882
N 2.658655 0.099467 -1.196043
N -2.992608 -0.053627 -0.481724
C 0.953631 3.638995 0.240778
C 2.160051 2.819904 0.640559
C -1.319383 -3.540369 -1.697831
C -1.208500 -3.697461 -0.197310
C 0.578826 1.221796 -0.525377
C -0.851399 -1.228144 -0.720181
C 1.267383 0.022698 -0.836456
C -1.553417 -0.014776 -0.492149
C 0.553481 -1.199451 -0.882705
C -0.830906 1.194838 -0.361790
C 3.638482 -0.631303 -0.519222
C -3.740904 0.475372 0.577291
C 6.038777 -0.692350 -0.172290
C -5.978454 0.401750 1.503521
C 6.084726 -0.713201 1.338432
C -6.605668 1.580175 0.793883
H 1.073199 4.589603 -0.289949
H 0.050740 3.640511 0.862012
H 2.135514 2.216943 1.549706
H 3.171672 3.168995 0.415599
H -2.161196 -3.970358 -2.246062
H -0.408956 -3.501649 -2.306317
H -0.218569 -3.768701 0.263609
H -1.967876 -4.243029 0.368266
H 2.944940 1.010985 -1.597418
H -3.387575 -0.912479 -0.921049
H 2.107188 -2.451005 -0.811724
H -2.277056 2.348341 0.393561
H 6.823395 -0.061149 -0.630890
H 6.030714 -1.703069 -0.616697
H -5.526238 0.672308 2.474485
H -6.657621 -0.465421 1.607029
H 7.031708 -1.127641 1.705635
H 5.273098 -1.333916 1.752345
H 5.972700 0.291858 1.764748
H -5.906135 2.427170 0.725406
H -6.903393 1.324421 -0.232138
H -7.499636 1.936628 1.320330


%chk=000184530-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184530

0 1
O 1.256769 -2.407088 -0.764677
O -1.344355 2.379349 0.817927
O 4.990892 0.125701 -0.649380
O -5.078330 -0.152545 0.702549
O 3.721699 -1.818093 -0.951060
O -3.808752 1.790892 1.004375
N 1.522026 2.340969 0.417834
N -1.609815 -2.368627 -0.364274
N 2.763753 0.241700 -0.291475
N -2.851281 -0.269056 0.344540
C 1.125392 3.750126 0.041006
C 1.320770 3.375988 1.500819
C -1.408827 -3.402300 -1.449105
C -1.212952 -3.778219 0.010100
C 0.654330 1.194311 0.241230
C -0.741845 -1.222081 -0.187788
C 1.361151 0.015052 -0.157784
C -1.448606 -0.042787 0.211139
C 0.665182 -1.210073 -0.376859
C -0.752682 1.182407 0.430316
C 3.789459 -0.574543 -0.644877
C -3.876859 0.547306 0.698048
C 6.214965 -0.667619 -0.971816
C -6.302365 0.640845 1.025306
C 6.774861 -1.343848 0.281872
C -6.862727 1.316442 -0.228475
H 1.903077 4.304281 -0.494986
H 0.093735 3.908604 -0.282958
H 0.412808 3.295741 2.103586
H 2.239895 3.659091 2.024489
H -2.327952 -3.684733 -1.973077
H -0.500903 -3.320760 -2.051788
H -0.181338 -3.937545 0.333736
H -1.990561 -4.333120 0.545499
H 2.942439 1.249948 -0.058724
H -3.030348 -1.277233 0.111991
H 2.282764 -2.310513 -0.881599
H -2.370501 2.282665 0.934659
H 6.904456 0.089302 -1.378500
H 5.958752 -1.408402 -1.748651
H -6.045770 1.381971 1.801669
H -6.991599 -0.115975 1.432613
H 7.729936 -1.845438 0.037909
H 6.074057 -2.106007 0.661840
H 6.967714 -0.603257 1.077119
H -6.161733 2.077917 -0.609473
H -7.056579 0.575422 -1.023064
H -7.817302 1.818836 0.015814


