%chk=000199280.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199280

0 1
O 4.769846 0.057395 -0.603800
O 3.959737 1.311669 1.687763
O 2.772251 -1.399211 -2.133237
O -3.122143 0.896269 -1.692241
O -0.898398 -0.924432 2.255805
N -1.587905 -0.035128 0.240973
C 0.791258 -0.308051 0.660464
C 3.446428 0.011672 -0.196461
C 2.996967 0.595034 1.019786
C 2.532797 -0.744549 -0.957400
C 1.673103 0.446441 1.445172
C 1.195276 -0.907145 -0.524775
C -0.622548 -0.475321 1.159540
C -3.001529 -0.070139 0.443968
C -3.839243 0.431483 -0.602431
C -3.609132 -0.564627 1.600707
C -5.224841 0.432170 -0.483559
C -5.007196 -0.562764 1.718480
C -5.806521 -0.071290 0.691155
C 5.310738 1.398266 -0.761430
C 3.600177 1.891756 2.968990
C 4.115561 -1.371176 -2.685730
C -3.871088 1.381563 -2.831207
H 1.323812 0.875909 2.381034
H 0.523065 -1.516279 -1.127967
H -1.284595 0.346328 -0.664143
H -2.992181 -0.957014 2.419129
H -5.859909 0.812806 -1.277003
H -5.461196 -0.953355 2.627959
H -6.890740 -0.073362 0.789767
H 5.361463 1.895041 0.215751
H 4.709742 1.971370 -1.469422
H 6.313155 1.191204 -1.150350
H 3.297920 1.107082 3.669994
H 2.820145 2.646786 2.838330
H 4.549587 2.348061 3.277364
H 4.836450 -1.747343 -1.949684
H 4.368118 -0.352743 -2.992118
H 4.015333 -2.047071 -3.542478
H -4.463679 2.256753 -2.549080
H -4.492702 0.582350 -3.245622
H -3.066981 1.656493 -3.526195


%chk=000199280-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000199280

0 1
O 4.790367 0.386378 -0.782439
O 4.248550 0.832295 1.937722
O 2.641691 -0.221070 -2.553011
O -3.140188 0.304031 -1.889675
O -0.817091 0.132828 2.448568
N -1.644361 0.195832 0.255216
C 0.779159 0.208769 0.621383
C 3.479560 0.344701 -0.283270
C 3.158349 0.563926 1.093771
C 2.429650 -0.003294 -1.180189
C 1.821642 0.506418 1.532463
C 1.091731 -0.066605 -0.729983
C -0.615782 0.169419 1.191253
C -3.039260 0.121464 0.483969
C -3.864563 0.177577 -0.684274
C -3.653346 -0.004035 1.753086
C -5.266715 0.107918 -0.586574
C -5.062861 -0.075013 1.847214
C -5.867659 -0.019448 0.690074
C 5.556895 1.634068 -0.559769
C 3.963875 1.000576 3.368172
C 3.630439 -1.256554 -2.929067
C -3.897851 0.376130 -3.139016
H 1.540968 0.668016 2.576764
H 0.341882 -0.361796 -1.471167
H -1.399839 0.302085 -0.733602
H -3.017160 -0.040950 2.638881
H -5.892997 0.150526 -1.482698
H -5.527521 -0.172743 2.833985
H -6.958609 -0.073361 0.769754
H 5.729886 1.795304 0.516259
H 5.016913 2.494726 -0.997349
H 6.508962 1.478046 -1.089386
H 3.488754 0.093789 3.787192
H 3.312915 1.877228 3.548111
H 4.945843 1.160188 3.837107
H 3.301273 -2.247253 -2.559866
H 4.626826 -1.012461 -2.526980
H 3.640589 -1.252184 -4.029746
H -4.568267 1.256847 -3.146346
H -4.489636 -0.545592 -3.298468
H -3.142609 0.476175 -3.932273


