%chk=000191452.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191452

1 1
O -1.661694 -2.201770 0.398548
O -4.266605 -2.227580 0.074050
O -5.678102 0.175098 -0.298482
O 4.684484 1.567882 0.621713
O 6.344544 -0.739568 0.151026
N 0.646008 1.338113 0.409482
C -0.161261 2.574818 0.671968
C -1.358464 2.635999 -0.276263
C -0.028480 0.122363 0.099963
C -1.483293 0.158024 0.043161
C -2.178349 1.379488 -0.176353
C 1.999946 1.401518 0.467802
C 0.739747 -1.000122 -0.143271
C 2.796377 0.257890 0.237245
C 2.160056 -0.984570 -0.078940
C -2.270695 -1.011080 0.170259
C -3.558198 1.433171 -0.300814
C -3.676994 -0.975046 0.049488
C -4.329522 0.250889 -0.201698
C 4.233072 0.321438 0.311661
C 2.955674 -2.137594 -0.317267
C 4.975799 -0.839094 0.070783
C 4.328776 -2.064297 -0.243225
C -5.338499 -2.377079 1.050174
C -6.429346 1.394200 -0.567232
C 6.126440 1.773505 0.733119
H 0.474470 3.483777 0.561380
H -0.507529 2.542658 1.737530
H -1.034984 2.781413 -1.334108
H -1.965310 3.540481 -0.041905
H 2.494401 2.363941 0.704918
H 0.235673 -1.948869 -0.396845
H -4.053933 2.384593 -0.483614
H 2.463968 -3.083798 -0.558814
H 4.941850 -2.952447 -0.425921
H -2.360418 -2.947176 0.472784
H -5.633840 -3.422724 0.894431
H -6.162331 -1.696973 0.801341
H -4.962534 -2.205590 2.060236
H -6.135221 1.816677 -1.532508
H -6.312295 2.102632 0.257074
H -7.457963 1.003294 -0.610488
H 6.786811 -1.612543 -0.035648
H 6.531865 1.143565 1.532737
H 6.174192 2.840052 0.985750
H 6.608608 1.556741 -0.226625


%chk=000191452-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191452

1 1
O -1.734175 -2.310987 0.342862
O -4.312058 -2.259699 0.123829
O -5.739224 0.216901 -0.287687
O 4.744267 1.617471 0.517548
O 6.440299 -0.754741 0.091039
N 0.675178 1.289105 0.406193
C -0.120486 2.522235 0.721629
C -1.323918 2.625021 -0.220631
C -0.017740 0.079586 0.146993
C -1.486538 0.124316 0.087922
C -2.168467 1.368315 -0.103736
C 2.034132 1.358732 0.439299
C 0.764995 -1.069154 -0.053405
C 2.846906 0.227037 0.229905
C 2.186952 -1.041377 -0.017859
C -2.294387 -1.049212 0.167500
C -3.565931 1.430149 -0.216037
C -3.709628 -0.990059 0.076771
C -4.357646 0.252086 -0.145653
C 4.287041 0.337331 0.269824
C 2.991515 -2.200058 -0.224677
C 5.044007 -0.838557 0.058442
C 4.381483 -2.083602 -0.184129
C -5.540448 -2.452568 0.939797
C -6.446697 1.476955 -0.579852
C 6.185613 1.967857 0.616126
H 0.550293 3.391019 0.629889
H -0.460165 2.441227 1.771198
H -0.972465 2.765352 -1.262382
H -1.910763 3.520581 0.045935
H 2.483822 2.332245 0.642608
H 0.242457 -2.008844 -0.235426
H -4.042795 2.401264 -0.374789
H 2.519765 -3.168012 -0.413903
H 5.000718 -2.976046 -0.343829
H -2.498017 -2.960613 0.374145
H -5.754759 -3.528518 0.868671
H -6.365770 -1.858668 0.522148
H -5.348578 -2.165302 1.989659
H -6.086011 1.917655 -1.526989
H -6.331231 2.197043 0.250949
H -7.502289 1.189643 -0.680296
H 6.865901 -1.633034 -0.070725
H 6.663617 1.411957 1.436619
H 6.177720 3.046956 0.826376
H 6.700407 1.757311 -0.333270


