%chk=000189239.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189239

0 1
O -2.626133 2.817865 -0.000664
O -4.375753 1.544665 -0.000208
N -3.165751 1.722102 0.000102
C -0.428493 -0.797953 -0.000011
C -0.838096 0.598285 0.000042
C 0.890568 -1.238558 -0.000087
C -1.575545 -1.654522 -0.000047
C 1.912440 -0.197451 -0.000068
C 1.512505 1.170812 -0.000035
C -2.315457 0.539363 0.000052
C 0.109993 1.566300 0.000002
C -2.747936 -0.763875 0.000000
C 1.063843 -2.649510 -0.000178
C -1.374673 -3.020454 -0.000118
C 3.292513 -0.513885 -0.000078
C -0.037343 -3.497957 -0.000188
C 2.511693 2.178438 -0.000016
C 4.246516 0.488575 -0.000061
C 3.853752 1.844369 -0.000036
H -0.147893 2.629066 -0.000008
H -3.773261 -1.107229 -0.000007
H 2.071728 -3.065029 -0.000255
H -2.204508 -3.724622 -0.000121
H 3.599299 -1.559403 -0.000093
H 0.122058 -4.577433 -0.000240
H 2.207891 3.226260 0.000012
H 5.307437 0.239408 -0.000070
H 4.616106 2.622772 -0.000022


%chk=000189239-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189239

0 1
O -2.643357 2.874750 0.000271
O -4.477752 1.505079 0.000136
N -3.195647 1.697373 -0.000148
C -0.444472 -0.792074 -0.000137
C -0.850111 0.590802 -0.000165
C 0.889545 -1.241561 -0.000089
C -1.593488 -1.646790 -0.000166
C 1.931959 -0.211156 -0.000077
C 1.526142 1.185332 -0.000110
C -2.322012 0.547049 -0.000175
C 0.127322 1.576099 -0.000157
C -2.770074 -0.776263 -0.000239
C 1.065018 -2.663166 -0.000061
C -1.395848 -3.041085 -0.000133
C 3.322325 -0.515739 -0.000036
C -0.053961 -3.527115 -0.000083
C 2.534329 2.199398 -0.000097
C 4.290200 0.501466 -0.000024
C 3.895444 1.868746 -0.000055
H -0.138825 2.637452 -0.000166
H -3.816976 -1.080634 -0.000274
H 2.068303 -3.102383 -0.000024
H -2.235792 -3.743799 -0.000156
H 3.647158 -1.561590 -0.000012
H 0.116404 -4.609162 -0.000065
H 2.222134 3.250009 -0.000120
H 5.354412 0.242211 0.000009
H 4.655120 2.657152 -0.000045


