%chk=000215345.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215345

0 1
O -5.948664 1.213855 0.196278
O 0.368129 -2.126883 -1.705476
O 3.115438 -2.403314 0.098627
O -0.032369 0.924753 -0.564785
O 4.606508 2.095146 0.466336
N -3.367124 -0.021100 0.072040
C -2.424255 -1.158843 -0.195881
C -4.123313 0.325158 -1.179023
C -4.340174 -0.364869 1.161690
C -1.394063 -1.258409 0.943251
C -5.044494 1.518908 -0.885062
C -5.254527 0.845189 1.406195
C -0.258842 -2.227223 0.595031
C 0.555727 -1.719315 -0.582858
C 1.590080 -0.691171 -0.262357
C 2.920903 -1.049778 0.040257
C 1.283961 0.684717 -0.295516
C 3.914949 -0.097338 0.283971
C 2.243167 1.681347 -0.057555
C 3.550091 1.259788 0.219644
C 4.460335 -2.896999 0.331300
C -0.543593 2.279220 -0.492461
C 4.380136 3.526788 0.420787
H -2.938745 -2.131481 -0.339752
H -1.884767 -0.942337 -1.149676
H -4.723863 -0.524232 -1.570833
H -3.389632 0.597134 -1.967814
H -3.765823 -0.595279 2.083942
H -4.955278 -1.259926 0.925690
H -1.881575 -1.586518 1.880098
H -0.979970 -0.246450 1.148175
H -4.471303 2.425534 -0.625151
H -5.736737 1.727520 -1.719462
H -6.086457 0.609482 2.092234
H -4.688442 1.718900 1.773310
H 0.400639 -2.368830 1.473896
H -0.665626 -3.229353 0.350438
H 4.940264 -0.360192 0.511422
H 1.981649 2.727041 -0.102913
H 4.810979 -2.583665 1.318655
H 5.128660 -2.561939 -0.467834
H 4.306425 -3.983435 0.287211
H -0.182638 2.853212 -1.348869
H -1.630166 2.092205 -0.550123
H -0.283048 2.744867 0.460885
H 3.663398 3.820687 1.192665
H 4.053211 3.826164 -0.579254
H 5.382038 3.918062 0.641929


%chk=000215345-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215345

0 1
O -5.979229 1.031083 0.925981
O 0.347503 -1.701733 -2.313577
O 2.802229 -2.371184 0.425709
O 0.234459 1.156274 -1.495450
O 4.466546 2.155035 0.880190
N -3.392007 -0.127984 0.251157
C -2.448707 -1.115518 -0.333123
C -4.271142 0.469858 -0.786954
C -4.221336 -0.678830 1.353675
C -1.325936 -1.527545 0.640991
C -5.150207 1.567087 -0.167374
C -5.109397 0.426499 1.948880
C -0.237022 -2.401832 -0.052164
C 0.554480 -1.589776 -1.074900
C 1.550187 -0.581575 -0.536604
C 2.689984 -0.986908 0.213347
C 1.397833 0.805527 -0.799534
C 3.649175 -0.060264 0.671560
C 2.339901 1.763949 -0.345426
C 3.462047 1.310613 0.384629
C 3.992978 -2.862390 1.124191
C 0.012124 2.567399 -1.810178
C 4.350443 3.589167 0.606947
H -2.983892 -2.034302 -0.690181
H -1.988419 -0.645343 -1.221238
H -4.932015 -0.300181 -1.261631
H -3.637363 0.907631 -1.581822
H -3.562890 -1.072929 2.149052
H -4.869834 -1.519882 0.995010
H -1.735073 -2.109632 1.489001
H -0.867974 -0.612761 1.062604
H -4.503653 2.384051 0.221400
H -5.862691 1.974233 -0.904237
H -5.793452 0.020220 2.712621
H -4.465408 1.211409 2.402108
H 0.457045 -2.793148 0.712016
H -0.710254 -3.252999 -0.576245
H 4.537976 -0.356633 1.231415
H 2.193809 2.825981 -0.547959
H 4.047749 -2.464987 2.155989
H 4.915183 -2.597421 0.572987
H 3.876596 -3.955667 1.151129
H 0.825624 2.971177 -2.443441
H -0.934301 2.586671 -2.369964
H -0.087891 3.176680 -0.890554
H 3.434546 4.013168 1.062866
H 4.354596 3.792596 -0.481500
H 5.238278 4.041911 1.071902


