%chk=000188573.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188573

0 1
O -3.742969 0.889766 0.656507
O -0.448256 -0.432116 -2.328853
O 0.342844 -1.362742 2.414356
N -1.166671 0.817534 -0.559738
N 0.495339 -1.995157 0.220239
C 1.917563 -0.005546 -0.035466
C 3.039801 -0.490364 0.835981
C 2.224063 1.357753 -0.590335
C 4.089954 0.635546 0.869565
C 3.681595 1.666877 -0.201765
C 0.778049 -0.678484 -0.283388
C -1.302762 0.982035 0.910030
C -2.352957 1.296632 -1.320526
C -0.325824 -0.133669 -1.150073
C -2.623268 0.363896 1.398391
C -3.638915 0.665266 -0.764589
C 0.283479 -2.247907 1.575180
H 2.660779 -0.722546 1.855382
H 3.465467 -1.432934 0.443885
H 2.078869 1.390123 -1.688109
H 1.526192 2.110962 -0.172328
H 4.119362 1.104559 1.868985
H 5.102803 0.244001 0.680484
H 4.340208 1.590585 -1.084932
H 3.785284 2.697619 0.174962
H -1.283467 2.072468 1.135056
H -0.442223 0.519298 1.455291
H -2.228814 1.053911 -2.402682
H -2.393580 2.404926 -1.228228
H -2.620804 -0.736177 1.317842
H -2.864840 0.665355 2.433933
H -4.548243 1.162287 -1.147241
H -3.688226 -0.419181 -0.963635
H 0.410959 -2.720279 -0.490436
H 0.068407 -3.302899 1.810858


%chk=000188573-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188573

0 1
O -3.717499 1.645875 0.436628
O -0.751648 -1.208955 -1.940127
O 1.398820 -2.506162 2.358448
N -1.221713 0.645793 -0.605137
N 0.737672 -2.286223 0.100963
C 1.761525 -0.042362 0.264110
C 3.086430 -0.525723 0.843128
C 1.857521 1.456727 -0.007939
C 3.981573 0.741451 0.934627
C 3.384862 1.708539 -0.121269
C 0.714514 -0.858320 -0.073557
C -1.266951 1.288328 0.727962
C -2.301331 1.084806 -1.523750
C -0.469323 -0.472894 -0.928373
C -2.677904 1.125398 1.336516
C -3.676000 0.922283 -0.848008
C 1.037309 -2.995806 1.250509
H 2.934983 -1.033141 1.814162
H 3.526365 -1.287395 0.166562
H 1.285944 1.775362 -0.897077
H 1.463963 2.031328 0.857265
H 3.897532 1.189871 1.942990
H 5.048217 0.519104 0.758574
H 3.737475 1.432752 -1.133459
H 3.654621 2.764727 0.055571
H -1.033212 2.365753 0.624806
H -0.521422 0.818785 1.389765
H -2.239011 0.473146 -2.438932
H -2.136876 2.150569 -1.774761
H -2.869719 0.052348 1.556319
H -2.768570 1.711639 2.265810
H -4.474362 1.367531 -1.463403
H -3.891860 -0.154710 -0.681838
H 0.324643 -2.796775 -0.691270
H 0.922626 -4.092252 1.088789


