%chk=000240708.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240708

0 1
O 1.112701 3.703123 -0.178953
N -0.036843 1.841419 -0.039102
N 0.041516 3.179989 -0.217127
C -1.338784 1.203916 -0.083261
C 1.138701 0.997935 0.207616
C -2.739246 -0.777521 0.105706
C 2.985256 -0.349831 -0.595081
C -3.889853 0.001943 -0.181279
C 3.395567 -0.575617 0.745290
C -1.456315 -0.152162 0.151751
C 1.832005 0.456940 -0.849794
C -2.499043 1.996806 -0.374624
C 1.543562 0.782476 1.561371
C -3.733323 1.404372 -0.419565
C 2.648153 0.011686 1.816692
C -2.891195 -2.181730 0.344293
C 3.736099 -0.934967 -1.664386
C -5.171655 -0.630858 -0.225275
C 4.550014 -1.384148 0.994030
C -4.133489 -2.762573 0.295661
C 4.839096 -1.705856 -1.396028
C -5.289126 -1.978472 0.007445
C 5.251220 -1.933600 -0.049858
H -0.589615 -0.774787 0.375085
H 1.522681 0.632739 -1.880340
H -2.391032 3.067349 -0.558307
H 0.969196 1.239491 2.367092
H -4.621549 1.998358 -0.639857
H 2.977913 -0.163870 2.841016
H -2.003866 -2.773664 0.563411
H 3.414923 -0.753325 -2.689386
H -6.047797 -0.022688 -0.446358
H 4.859005 -1.551065 2.025117
H -4.258124 -3.829732 0.475787
H 5.417472 -2.154265 -2.202980
H -6.260292 -2.469354 -0.023732
H 6.131570 -2.549258 0.130332


%chk=000240708-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240708

0 1
O 1.206220 3.214546 -1.366656
N -0.047327 1.477727 -0.551861
N 0.029078 2.777472 -1.157585
C -1.384747 1.009118 -0.317925
C 1.114306 0.722819 -0.148449
C -2.963696 -0.843880 0.044137
C 3.330323 -0.215528 -0.629653
C -4.058160 0.102182 0.117883
C 3.427278 -0.683498 0.738549
C -1.634851 -0.363217 -0.182505
C 2.157089 0.490021 -1.049796
C -2.467131 1.953553 -0.242799
C 1.212324 0.279482 1.214059
C -3.765388 1.498859 -0.033450
C 2.341605 -0.415193 1.638661
C -3.245061 -2.243079 0.192931
C 4.415767 -0.473829 -1.531059
C -5.386978 -0.382989 0.341702
C 4.602009 -1.392705 1.150581
C -4.551792 -2.688061 0.407766
C 5.548546 -1.168966 -1.101642
C -5.632118 -1.751766 0.483993
C 5.642959 -1.632312 0.249626
H -0.813047 -1.082973 -0.256433
H 2.082368 0.837416 -2.084066
H -2.253164 3.018490 -0.349335
H 0.391757 0.494116 1.905861
H -4.587883 2.221040 0.028759
H 2.414720 -0.757761 2.677333
H -2.417950 -2.960560 0.134689
H 4.344565 -0.114839 -2.564496
H -6.212445 0.336645 0.398124
H 4.674056 -1.744048 2.186741
H -4.756564 -3.758444 0.519044
H 6.372501 -1.361343 -1.797182
H -6.651633 -2.114845 0.653176
H 6.537967 -2.174449 0.573683


