%chk=000213326.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213326

0 1
O 5.247460 0.667686 1.880523
N -1.233413 1.196014 0.112971
C -2.263017 0.239252 -0.080819
C 0.177169 0.943804 -0.005256
C -1.832376 2.448666 0.374821
C -3.481910 0.899217 0.072807
C -3.214901 2.269664 0.356290
C -2.027974 -1.177417 -0.356130
C 2.924641 0.464215 -0.243334
C 0.679642 0.326257 -1.163205
C 1.043330 1.315680 1.037990
C 2.049702 0.087280 -1.274015
C 2.410610 1.078824 0.909914
C -1.060043 3.688086 0.602446
C 4.403246 0.230187 -0.387226
C -2.735476 -1.800873 -1.398802
C -1.132735 -1.930225 0.422726
C 5.052856 -0.341147 0.878602
C -2.544561 -3.159912 -1.658174
C -0.946057 -3.288314 0.155664
C -1.649753 -3.905484 -0.883817
H -4.453977 0.453895 0.003199
H -3.953564 3.025295 0.525932
H 0.000714 0.029346 -1.964017
H 0.647763 1.777646 1.942225
H 2.434222 -0.395920 -2.171275
H 3.094043 1.358085 1.719870
H -1.631757 4.570754 0.276526
H -0.831714 3.827983 1.670097
H -0.106390 3.703036 0.054428
H 4.890068 1.191376 -0.660625
H 4.609068 -0.452185 -1.238383
H -3.431905 -1.219778 -2.001748
H -0.588881 -1.453025 1.237212
H 6.027037 -0.811336 0.655197
H 4.397720 -1.069446 1.396152
H -3.095165 -3.639462 -2.465593
H -0.252643 -3.868378 0.762127
H -1.503437 -4.963850 -1.087711
H 5.831861 1.376804 1.549507


%chk=000213326-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213326

0 1
O 5.322885 0.631343 2.008309
N -1.254841 1.179472 0.125465
C -2.277379 0.240418 -0.178440
C 0.165613 0.952292 0.020838
C -1.835730 2.450910 0.334576
C -3.495987 0.939686 -0.144485
C -3.220809 2.309387 0.176501
C -2.067414 -1.203043 -0.387339
C 2.978627 0.532740 -0.199102
C 0.724029 0.509210 -1.200934
C 1.011435 1.182323 1.131143
C 2.114322 0.294934 -1.299806
C 2.404295 0.984413 1.019330
C -1.026790 3.689409 0.600908
C 4.480029 0.310931 -0.352531
C -2.927448 -1.905187 -1.281455
C -1.071378 -1.949849 0.306535
C 5.198777 -0.300628 0.870872
C -2.799923 -3.296565 -1.472792
C -0.938125 -3.339841 0.104575
C -1.799784 -4.023827 -0.784630
H -4.477435 0.485073 -0.272648
H -3.946849 3.114202 0.284900
H 0.067110 0.325955 -2.056939
H 0.574016 1.501828 2.083075
H 2.533053 -0.061467 -2.249182
H 3.057067 1.157001 1.881269
H -1.689832 4.569221 0.553562
H -0.547721 3.685103 1.598466
H -0.220755 3.828944 -0.144133
H 4.981882 1.270534 -0.606216
H 4.654021 -0.357029 -1.219395
H -3.687106 -1.344095 -1.837451
H -0.414014 -1.446309 1.022134
H 6.203725 -0.663408 0.567577
H 4.626756 -1.151495 1.275454
H -3.473446 -3.812211 -2.167130
H -0.166232 -3.892183 0.652882
H -1.695312 -5.103807 -0.937607
H 5.886173 1.397918 1.730937


