%chk=000224077.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224077

0 1
O 4.819594 -2.571310 -0.668239
O 3.179766 -3.327048 0.521826
O 4.252631 3.549714 0.138240
O 5.861498 2.098150 0.103864
O -3.418556 -4.476590 -0.189332
O -4.258806 -2.482395 -0.120518
N -0.686111 1.779595 0.121838
N 3.774847 -2.438859 -0.060639
N 4.686031 2.413977 0.106884
N -3.323544 -3.262905 -0.140664
C 1.835101 -0.794562 0.006925
C 0.618616 -1.638474 -0.042864
C 1.416628 0.576180 0.064164
C -0.527366 -0.773311 -0.011445
C -0.079127 0.652639 0.060837
C 3.202468 -1.068924 -0.014807
C 2.313954 1.626517 0.102503
C 0.452887 -3.012161 -0.109970
C -1.809636 -1.283101 -0.035091
C 3.690763 1.309719 0.071348
C 4.136799 -0.008193 0.004935
C -1.952972 -2.687053 -0.106170
C -0.851418 -3.542029 -0.144185
C -2.101658 1.962956 0.094070
C -2.726180 2.496201 1.235399
C -2.839584 1.732034 -1.082155
C -4.841072 2.544746 0.035277
C -4.091908 2.777140 1.200101
C -4.201234 2.026643 -1.104616
C -6.304303 2.835993 -0.002078
H 1.975504 2.673827 0.151525
H 1.306560 -3.701199 -0.122840
H -2.700620 -0.641069 0.001152
H 5.219366 -0.226241 -0.036454
H -1.001404 -4.629079 -0.196691
H -2.145649 2.690990 2.136841
H -2.347858 1.345004 -1.972988
H -4.577576 3.184063 2.086943
H -4.775117 1.851149 -2.014577
H -6.889517 1.909337 -0.107175
H -6.663557 3.339417 0.905233
H -6.567440 3.482911 -0.851608


%chk=000224077-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224077

0 1
O 5.062666 -2.365978 -0.915492
O 3.332634 -3.417444 0.122567
O 4.056242 3.654693 0.475145
O 5.819562 2.231251 0.195571
O -3.370254 -4.765457 -0.214629
O -4.302726 -2.691986 -0.020624
N -0.732197 1.652670 0.366626
N 3.916311 -2.359211 -0.328313
N 4.558193 2.481790 0.288938
N -3.285737 -3.482228 -0.115530
C 1.840223 -0.873019 -0.023654
C 0.638581 -1.745378 -0.097798
C 1.376052 0.473777 0.164770
C -0.535294 -0.909866 0.008036
C -0.110072 0.511293 0.177976
C 3.249580 -1.045029 -0.129820
C 2.227294 1.578839 0.275720
C 0.489189 -3.146377 -0.231167
C -1.823347 -1.472666 0.021722
C 3.612650 1.340448 0.172857
C 4.133716 0.052951 -0.045450
C -1.929916 -2.872356 -0.114344
C -0.801976 -3.711260 -0.253605
C -2.106573 1.924573 0.236116
C -2.680020 2.841359 1.163344
C -2.912288 1.449395 -0.843607
C -4.852492 2.714661 0.006287
C -4.037103 3.200028 1.063480
C -4.253818 1.852348 -0.954799
C -6.310924 3.110143 -0.110919
H 1.827977 2.584422 0.427990
H 1.361950 -3.794769 -0.292361
H -2.729082 -0.874619 0.134256
H 5.211409 -0.097421 -0.146703
H -0.947922 -4.789185 -0.359706
H -2.045303 3.243231 1.959119
H -2.466866 0.811790 -1.615214
H -4.468296 3.882417 1.804796
H -4.851969 1.492289 -1.800262
H -6.972385 2.236209 0.043722
H -6.586554 3.874929 0.634446
H -6.540314 3.513141 -1.114688


