%chk=000291444.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291444

0 1
O -1.989805 -2.333272 -0.393410
O 3.299558 -2.961789 -0.760324
O 1.156549 -2.768988 -0.618694
O 5.438334 2.803553 -0.571846
O 6.228321 0.798581 -0.775395
O -3.148941 -2.355503 1.547228
N 0.011170 -0.435540 -0.571189
N -1.022325 0.450254 -0.337421
N 2.291947 -2.285301 -0.679808
N 5.310349 1.592802 -0.653144
C 1.301738 0.054440 -0.534548
C -2.265691 0.080233 -0.452032
C -3.290742 1.102782 -0.109301
C 2.420567 -0.839443 -0.639823
C -2.819681 -1.258443 -0.891477
C 1.567984 1.461304 -0.421454
C 3.733615 -0.315917 -0.684326
C 3.946275 1.050803 -0.600898
C 2.846396 1.948360 -0.455370
C -3.382723 2.298163 -0.834248
C -4.165852 0.844606 0.958532
C -4.365735 3.233472 -0.495980
C -5.140235 1.787578 1.290153
C -5.242947 2.979381 0.562705
C -2.247802 -2.816355 0.894492
C -1.265801 -3.884069 1.186833
H -3.867729 -1.413480 -0.561626
H -2.751928 -1.385811 -1.991812
H 0.717109 2.143790 -0.302505
H 4.589104 -1.010167 -0.782018
H -0.168687 -1.473769 -0.680135
H 3.054059 3.024275 -0.374108
H -2.690187 2.499378 -1.650524
H -4.077363 -0.085817 1.529337
H -4.443982 4.163732 -1.057510
H -5.820425 1.594730 2.119606
H -6.006329 3.711361 0.824628
H -0.873542 -3.796768 2.213273
H -0.397629 -3.873841 0.494077
H -1.725292 -4.883104 1.097861


%chk=000291444-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291444

0 1
O -1.834691 -2.375068 -0.149046
O 3.428524 -2.958240 -0.871721
O 1.173395 -2.743798 -0.622595
O 5.515860 2.953653 -0.915066
O 6.350292 0.832463 -1.085780
O -3.538206 -2.542356 1.434100
N 0.067324 -0.367711 -0.548574
N -0.959213 0.532300 -0.283346
N 2.374226 -2.228621 -0.753239
N 5.373418 1.667633 -0.950986
C 1.362957 0.106185 -0.618340
C -2.211443 0.096084 -0.353148
C -3.283584 1.071534 -0.039223
C 2.503666 -0.771317 -0.750564
C -2.593390 -1.296938 -0.845282
C 1.620185 1.516825 -0.574213
C 3.813662 -0.256172 -0.863498
C 4.006618 1.128784 -0.830447
C 2.911835 2.024839 -0.676215
C -3.076295 2.462145 -0.268298
C -4.525250 0.640287 0.510032
C -4.087943 3.394565 0.030040
C -5.532464 1.581048 0.812700
C -5.322954 2.957731 0.569016
C -2.425832 -2.923057 1.012614
C -1.542834 -4.002673 1.587654
H -3.672730 -1.481095 -0.750608
H -2.287737 -1.409775 -1.901725
H 0.760186 2.177117 -0.452064
H 4.660004 -0.939698 -0.968333
H -0.063929 -1.402225 -0.551165
H 3.106935 3.099786 -0.643031
H -2.121380 2.791015 -0.689695
H -4.680149 -0.415956 0.756483
H -3.920457 4.459949 -0.161936
H -6.477080 1.238781 1.248685
H -6.110491 3.683751 0.798709
H -1.533512 -3.926147 2.686785
H -0.522078 -3.938533 1.182344
H -1.963743 -4.990892 1.326775


