%chk=000182573.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182573

0 1
O 4.068119 -1.543701 1.102243
N -3.056169 0.829118 0.320304
C -1.063242 -0.135119 -0.900061
C -2.547881 -0.348319 -0.432931
C -0.598068 -1.582542 -1.212269
C -2.553900 -1.713015 0.303463
C -1.355955 -2.508525 -0.245153
C -0.226848 0.496621 0.202237
C -1.012226 0.758009 -2.144205
C -2.246356 1.155689 1.537397
C -0.772034 1.074083 1.280378
C 1.250337 0.482347 0.047866
C -4.495441 0.667229 0.685038
C 2.001333 -0.534447 0.646484
C 1.894598 1.503131 -0.676198
C 3.395644 -0.510183 0.491068
C 3.283477 1.499779 -0.812055
C 4.058843 0.490470 -0.232236
H -3.190311 -0.433955 -1.347675
H 0.493222 -1.699196 -1.119240
H -0.836428 -1.839815 -2.259048
H -3.502898 -2.245179 0.140610
H -2.457389 -1.574331 1.393298
H -0.696691 -2.832691 0.578788
H -1.685726 -3.427251 -0.757187
H -1.633889 0.364365 -2.954454
H -1.387700 1.763328 -1.907569
H 0.008117 0.857333 -2.528833
H -2.493900 0.512641 2.414564
H -2.514149 2.202334 1.820133
H -0.156211 1.529560 2.056967
H -5.082142 0.501351 -0.232834
H -4.858109 1.606678 1.132358
H -4.707778 -0.155454 1.383258
H 1.531084 -1.328536 1.221843
H 1.302130 2.298639 -1.123219
H 3.774148 2.293837 -1.375607
H 5.136646 0.488548 -0.339524
H 5.044543 -1.481532 0.969199


%chk=000182573-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182573

0 1
O 4.102811 -0.573595 2.246587
N -3.086535 0.692891 0.480535
C -1.155576 0.085059 -1.022058
C -2.555183 -0.324558 -0.443913
C -0.729138 -1.253672 -1.692069
C -2.368121 -1.790389 0.093695
C -1.122279 -2.354349 -0.664300
C -0.223555 0.463528 0.152450
C -1.344150 1.265207 -2.011284
C -2.234428 0.950349 1.651261
C -0.761086 0.879905 1.337631
C 1.267296 0.350358 0.025590
C -4.509802 0.549825 0.820426
C 2.033404 -0.064953 1.148729
C 1.965300 0.638270 -1.184553
C 3.438702 -0.153713 1.076471
C 3.370652 0.543386 -1.248371
C 4.126716 0.151499 -0.121588
H -3.254381 -0.356914 -1.304803
H 0.340385 -1.291133 -1.957231
H -1.309838 -1.376001 -2.628249
H -3.273609 -2.396364 -0.089551
H -2.196536 -1.783478 1.185891
H -0.287362 -2.523955 0.039981
H -1.329982 -3.319539 -1.160035
H -1.921568 0.931004 -2.895350
H -1.911590 2.068839 -1.508567
H -0.393667 1.693229 -2.371269
H -2.437184 0.230349 2.493530
H -2.483591 1.953488 2.057830
H -0.097607 1.184735 2.157872
H -5.105248 0.452349 -0.105206
H -4.857852 1.453793 1.355348
H -4.732664 -0.333915 1.469768
H 1.544863 -0.352926 2.084196
H 1.416955 0.956649 -2.073699
H 3.886546 0.780709 -2.185416
H 5.220416 0.076640 -0.178634
H 5.079285 -0.621308 2.095556


