%chk=000276233.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276233

0 1
O 3.227580 2.540823 -0.000053
O -3.265245 -2.435973 0.000050
O -4.648763 -0.780764 -0.000176
N 0.999812 2.188483 -0.000071
N -3.504610 -1.238145 -0.000029
N -3.797119 1.697168 -0.000208
C 0.049256 -0.066488 -0.000060
C 1.398812 -0.629042 -0.000019
C -0.128398 1.363441 -0.000107
C 2.514261 0.237254 0.000015
C -1.089556 -0.859132 -0.000047
C -1.402918 1.933263 -0.000194
C 2.353412 1.698496 0.000078
C -2.392134 -0.314949 -0.000110
C -2.559378 1.113537 -0.000196
C 1.628182 -2.021559 -0.000050
C 3.824371 -0.283261 -0.000006
C 2.924915 -2.524442 -0.000061
C 4.030112 -1.656979 -0.000040
H -0.994735 -1.958344 0.000032
H 0.878726 3.207919 -0.000137
H -1.517894 3.013993 -0.000225
H 0.783402 -2.711560 -0.000069
H 4.670133 0.412047 0.000013
H 3.087906 -3.604052 -0.000084
H 5.040610 -2.062457 -0.000052
H -3.904632 2.697395 -0.000286
H -4.652307 1.133127 -0.000209


%chk=000276233-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276233

0 1
O 3.284912 2.559413 -0.000400
O -3.321238 -2.489424 -0.001304
O -4.765442 -0.727085 -0.001512
N 1.005661 2.153137 -0.000237
N -3.545508 -1.214432 0.000399
N -3.831865 1.733520 0.000134
C 0.041044 -0.090787 0.000045
C 1.403054 -0.649438 0.000031
C -0.130966 1.342079 -0.000084
C 2.526685 0.237935 -0.000127
C -1.126287 -0.871096 0.000186
C -1.409557 1.927778 -0.000067
C 2.344031 1.709053 -0.000281
C -2.416317 -0.296497 0.000240
C -2.594123 1.140552 0.000082
C 1.663479 -2.049578 0.000169
C 3.852385 -0.264249 -0.000146
C 2.980236 -2.539857 0.000149
C 4.085030 -1.648381 -0.000008
H -1.082492 -1.962510 0.000300
H 0.895748 3.172315 -0.000330
H -1.503416 3.020121 -0.000165
H 0.834865 -2.763743 0.000295
H 4.673265 0.460342 -0.000273
H 3.152771 -3.621501 0.000260
H 5.107558 -2.038525 -0.000021
H -3.917793 2.746623 0.000053
H -4.651918 1.114035 0.000312


