%chk=000279316.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279316

0 1
O 1.139133 2.521500 0.060223
O 1.421858 -2.119292 0.255495
O -1.834243 -2.634571 0.164639
O 3.673750 1.387304 0.190080
N 1.699291 0.214712 0.171399
N -2.913083 -0.648378 0.048350
C -0.584947 0.780652 0.070666
C -0.497819 -0.606897 0.129224
C 0.825903 1.369135 0.095399
C 0.911171 -1.037606 0.194671
C -1.784800 1.474572 0.001870
C -2.969465 0.725002 -0.008524
C -1.659439 -1.441705 0.122918
C 3.155212 0.301664 0.217195
C -4.311807 1.363032 -0.080316
C 3.873199 -1.000412 0.295177
H -1.801810 2.562889 -0.042394
H -3.781228 -1.200347 0.040735
H -4.250781 2.464831 -0.112350
H -4.941666 1.116934 0.791187
H -4.871827 1.061509 -0.981705
H 3.588271 -1.587504 1.185979
H 4.962592 -0.844337 0.326118
H 3.648235 -1.659086 -0.562136


%chk=000279316-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279316

0 1
O 1.118045 2.542045 0.059050
O 1.372728 -2.207829 0.268262
O -1.843799 -2.698626 0.172935
O 3.698014 1.407764 0.209201
N 1.698519 0.188900 0.178185
N -2.906737 -0.614673 0.049290
C -0.578121 0.767157 0.074451
C -0.513317 -0.625434 0.134850
C 0.817788 1.332779 0.101131
C 0.900953 -1.054156 0.203195
C -1.783664 1.500804 0.000487
C -2.975844 0.763641 -0.011286
C -1.714102 -1.447015 0.126184
C 3.147953 0.285177 0.223607
C -4.348331 1.385204 -0.087687
C 3.926564 -1.013817 0.288053
H -1.785992 2.590569 -0.045048
H -3.775446 -1.163279 0.041091
H -4.274586 2.482244 -0.126331
H -4.960433 1.113956 0.792813
H -4.890808 1.046474 -0.990190
H 3.657327 -1.606903 1.178285
H 4.994896 -0.752457 0.314571
H 3.714090 -1.658923 -0.581197


