%chk=000180420.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180420

0 1
O 2.092934 -2.838527 0.000242
O -1.218382 -3.069781 0.000232
N 3.315572 -0.884681 0.000127
N -2.640440 -1.229690 0.000060
C 3.124380 0.603373 0.000081
C 1.592973 0.718683 0.000037
C 1.013775 -0.616082 0.000093
C -0.338199 -0.741992 0.000182
C -1.109428 0.470055 0.000157
C 0.848633 1.866461 0.000042
C -0.588068 1.765048 0.000090
C 2.121380 -1.631561 0.000019
C 3.730121 1.212105 1.266983
C 3.730212 1.212034 -1.266811
C -2.524573 0.183373 0.000151
C -1.338278 -1.875986 0.000300
C -1.541710 2.830158 0.000079
C -3.424262 1.223550 0.000109
C -2.894167 2.550280 0.000089
C -3.916698 -1.957765 0.000361
H 4.234241 -1.299491 0.000274
H 1.311158 2.851057 0.000029
H 3.302234 0.763775 2.174170
H 4.814621 1.059153 1.313517
H 3.548321 2.291329 1.319305
H 3.548433 2.291258 -1.319196
H 4.814712 1.059060 -1.313270
H 3.302375 0.763664 -2.174003
H -1.186368 3.857019 0.000034
H -4.497210 1.068430 0.000092
H -3.612625 3.373306 0.000050
H -4.509574 -1.715968 0.898981
H -3.719086 -3.048733 0.000015
H -4.510207 -1.715514 -0.897721


%chk=000180420-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180420

0 1
O 2.071447 -2.896317 0.000187
O -1.228638 -3.120275 0.000275
N 3.307208 -0.876748 0.000149
N -2.665427 -1.223593 0.000192
C 3.134156 0.596168 0.000108
C 1.601728 0.698102 0.000086
C 1.022368 -0.619608 0.000125
C -0.372831 -0.741165 0.000115
C -1.125791 0.463172 0.000092
C 0.840872 1.872939 0.000046
C -0.591852 1.778589 0.000054
C 2.131790 -1.639246 0.000132
C 3.756070 1.223825 1.277282
C 3.756106 1.223758 -1.277082
C -2.525757 0.176096 0.000137
C -1.375004 -1.874298 0.000096
C -1.545203 2.857865 0.000035
C -3.444770 1.227600 0.000135
C -2.918540 2.569346 0.000074
C -3.920678 -1.968822 0.000372
H 4.225257 -1.322383 0.000189
H 1.323828 2.857573 0.000026
H 3.322177 0.770269 2.184489
H 4.849950 1.062209 1.290432
H 3.573552 2.313057 1.305675
H 3.573589 2.312988 -1.305537
H 4.849986 1.062140 -1.290194
H 3.322237 0.770154 -2.184277
H -1.200387 3.897443 0.000000
H -4.526894 1.064029 0.000183
H -3.634999 3.398870 0.000069
H -4.520739 -1.742375 0.901134
H -3.666860 -3.041900 0.000135
H -4.521151 -1.742062 -0.900033


