%chk=000215245.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215245

1 1
O -3.586829 0.081882 -0.892566
O -3.414275 -0.571981 2.790686
O -2.886144 2.537682 -0.351675
O -1.577318 -2.366675 0.260277
O 0.939749 -2.743912 0.310540
O 2.870473 2.250133 -0.633162
O -3.813169 -2.171854 -0.793951
O 5.296045 1.238863 -0.894075
N -0.024631 3.135742 -0.223330
N -0.007790 4.220513 -0.479456
C -3.632613 0.358134 0.542406
C -3.198178 -0.855034 1.415634
C -2.630415 1.560461 0.651433
C -1.724754 -1.306551 1.252680
C -0.828835 -0.238284 0.735627
C -1.221132 1.071829 0.520081
C 0.561380 -0.372738 0.379663
C -5.052520 0.776263 0.859810
C -0.050769 1.816095 0.087670
C 1.041830 0.905648 0.020593
C 1.384228 -1.530868 0.254999
C 2.460884 1.130973 -0.341545
C 2.830159 -1.363799 -0.006887
C 3.323918 -0.049125 -0.309120
C -3.761009 -1.165880 -1.463021
C 3.678224 -2.451440 0.023950
C 4.697285 0.086280 -0.582212
C -3.842538 -1.002824 -2.932439
C 5.073742 -2.283009 -0.243064
C 5.581333 -1.049031 -0.541943
H -3.899460 -1.721982 1.241601
H -2.790643 2.125372 1.605059
H -1.368588 -1.725208 2.231185
H -5.305288 1.752085 0.415984
H -5.789349 0.056353 0.472634
H -5.232559 0.846579 1.945100
H -2.900942 0.207835 3.099215
H -3.143796 2.098840 -1.209010
H -2.324499 -3.035080 0.309145
H 3.301259 -3.455393 0.249662
H -0.193950 -2.843654 0.385769
H 4.649736 2.051720 -0.923793
H -3.739624 0.041957 -3.268287
H -4.816011 -1.370195 -3.312596
H -3.066820 -1.599310 -3.445237
H 5.724491 -3.165006 -0.205595
H 6.643512 -0.880606 -0.756438


%chk=000215245-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215245

1 1
O -3.539073 0.088927 -0.963803
O -3.549368 -0.477485 2.867140
O -2.939015 2.618079 -0.234183
O -1.522356 -2.612383 0.724586
O 0.919656 -2.779066 0.563036
O 2.867696 2.280355 -0.683155
O -3.207208 -2.219353 -1.128059
O 5.211395 1.289945 -1.009745
N -0.024773 3.095987 -0.204442
N 0.018302 4.225386 -0.478797
C -3.639392 0.331248 0.555549
C -3.217085 -0.866467 1.487135
C -2.663008 1.548885 0.724816
C -1.721117 -1.312536 1.419150
C -0.836802 -0.262245 0.805690
C -1.241921 1.055467 0.581690
C 0.564504 -0.391176 0.449475
C -5.106135 0.714685 0.780244
C -0.069660 1.786502 0.117658
C 1.049287 0.881048 0.044870
C 1.404044 -1.559623 0.372982
C 2.433602 1.103514 -0.344693
C 2.819503 -1.383563 0.031745
C 3.309098 -0.074170 -0.312882
C -3.502553 -1.110024 -1.648934
C 3.695375 -2.491593 0.029290
C 4.689233 0.082694 -0.657371
C -3.861734 -0.935147 -3.101400
C 5.067186 -2.314237 -0.304980
C 5.565409 -1.049543 -0.644348
H -3.869661 -1.732247 1.298318
H -2.850265 2.017858 1.708921
H -1.415308 -1.533006 2.459639
H -5.360373 1.618770 0.204353
H -5.773515 -0.108042 0.470773
H -5.284547 0.906925 1.850357
H -2.862658 0.130703 3.245551
H -3.133721 2.193668 -1.112929
H -2.177337 -2.661322 -0.065500
H 3.306330 -3.479712 0.290514
H -0.213937 -2.829130 0.637951
H 4.462987 1.999695 -0.979826
H -3.532329 0.042789 -3.485179
H -4.962166 -0.977730 -3.206902
H -3.428681 -1.752801 -3.695456
H 5.740807 -3.175871 -0.298421
H 6.615086 -0.892859 -0.908428


