%chk=000238778.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238778

0 1
O 3.312210 2.573387 -0.049199
O 3.821853 -2.161645 0.117571
C 0.830014 -0.177451 -0.243984
C 1.702011 -1.261332 -0.132555
C 1.314827 1.144418 -0.222652
C 2.691635 1.346904 -0.083839
C 3.083688 -1.008986 0.012127
C -0.614690 -0.435362 -0.400830
C 3.607786 0.283816 0.039117
C -2.994824 -0.098998 0.205276
C -1.552356 0.159397 0.347835
C -3.484423 -1.401907 0.016920
C -3.897628 0.977103 0.271508
C -4.858555 -1.622864 -0.109073
C -5.268878 0.749754 0.139022
C -5.752402 -0.549468 -0.050842
C 2.488171 3.758432 -0.174337
C 5.257970 -2.038374 0.270987
H 1.346774 -2.287040 -0.145670
H 0.623611 1.970643 -0.323897
H -0.868018 -1.161201 -1.178816
H 4.663219 0.498876 0.146257
H -1.286160 0.885248 1.122513
H -2.792715 -2.241826 -0.022170
H -3.526946 1.989447 0.419507
H -5.232887 -2.635273 -0.252837
H -5.964083 1.586460 0.185040
H -6.821637 -0.723677 -0.151315
H 1.784745 3.820398 0.660801
H 1.976083 3.763724 -1.140965
H 3.236965 4.559187 -0.120099
H 5.495169 -1.505272 1.196276
H 5.691075 -1.546777 -0.605001
H 5.568396 -3.089440 0.329021


%chk=000238778-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238778

0 1
O 3.340964 2.576286 0.034345
O 3.979057 -2.236087 0.005167
C 0.855456 -0.259881 0.002519
C 1.775431 -1.335669 0.000067
C 1.350929 1.081050 0.014011
C 2.740600 1.305035 0.022579
C 3.170959 -1.088859 0.008696
C -0.582178 -0.579338 -0.006613
C 3.668683 0.229366 0.020129
C -3.060784 -0.014710 -0.016092
C -1.624658 0.309798 -0.007215
C -3.567003 -1.348868 -0.020781
C -4.004947 1.053606 -0.020110
C -4.953204 -1.596988 -0.029191
C -5.393553 0.806108 -0.028522
C -5.876886 -0.522532 -0.033156
C 2.457465 3.743132 0.043285
C 5.430066 -2.038619 0.014012
H 1.427561 -2.373604 -0.008327
H 0.651416 1.920064 0.016196
H -0.806967 -1.655054 -0.013453
H 4.735106 0.465708 0.027635
H -1.400401 1.386267 -0.001250
H -2.874013 -2.197388 -0.017453
H -3.637563 2.087887 -0.016692
H -5.319458 -2.630027 -0.032314
H -6.097277 1.646141 -0.031532
H -6.954428 -0.720189 -0.039571
H 1.814989 3.755443 0.945476
H 1.822985 3.775212 -0.864104
H 3.130450 4.613149 0.055694
H 5.756794 -1.498583 0.924024
H 5.766183 -1.485843 -0.884859
H 5.858225 -3.051711 0.009099


