%chk=000287289.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287289

0 1
O 0.661243 -0.375842 -1.704363
O 1.756714 1.524236 -0.319621
O -3.093601 -2.150022 -0.553109
O -7.680951 -1.857868 -0.039025
N -6.010937 -0.202451 -0.108340
N -5.382784 -2.376253 -0.289474
C -0.197989 0.400953 -0.947723
C -2.397706 1.097328 -0.205809
C 0.391677 1.482161 -0.226064
C -1.575193 0.222693 -0.943728
C -1.811579 2.168857 0.487283
C -0.425806 2.367900 0.479437
C -3.850771 0.946525 -0.147895
C 0.529481 -1.817527 -1.529418
C 2.450300 2.612473 0.372347
C -4.575925 -0.183481 -0.215925
C 1.186560 -2.281887 -0.258475
C 3.908770 2.374356 0.091081
C -4.164604 -1.630700 -0.373348
C 0.777041 -3.487768 0.328997
C 2.219988 -1.535625 0.323480
C 4.868510 2.910689 0.962623
C 4.310980 1.642712 -1.034406
C -6.527545 -1.523307 -0.129183
C 1.409759 -3.946734 1.487595
C 2.846533 -1.997313 1.483415
C 6.227082 2.716350 0.700555
C 5.671720 1.446635 -1.285721
C 2.445393 -3.204530 2.064972
C 6.630511 1.984373 -0.421550
H -2.007263 -0.603178 -1.514831
H -2.435360 2.859221 1.055062
H -0.005350 3.202198 1.032989
H -4.389104 1.897650 -0.007707
H 1.076433 -2.177585 -2.425055
H -0.535274 -2.110344 -1.592161
H 2.209564 2.551819 1.449016
H 2.105362 3.573187 -0.053849
H -6.575005 0.625634 0.012479
H -0.035623 -4.064483 -0.108978
H 2.517388 -0.583215 -0.130845
H 4.562762 3.476071 1.840101
H 3.555137 1.222233 -1.704103
H -5.448099 -3.388019 -0.347959
H 1.092573 -4.883029 1.942585
H 3.649124 -1.415061 1.932595
H 6.973623 3.134387 1.373910
H 5.983375 0.873551 -2.157997
H 2.936111 -3.564808 2.966350
H 7.689756 1.832938 -0.620612


%chk=000287289-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287289

0 1
O 1.222375 -0.564780 -1.104711
O 2.104905 1.773902 -0.294560
O -3.012153 -2.273414 -1.068696
O -7.582002 -1.777701 0.009430
N -5.682414 -0.355721 0.306402
N -5.341862 -2.324812 -0.661456
C 0.259162 0.270821 -0.534195
C -2.020410 0.895116 0.165428
C 0.743226 1.557370 -0.116721
C -1.098657 -0.049107 -0.387042
C -1.521955 2.166085 0.577292
C -0.161051 2.493156 0.438363
C -3.446740 0.659785 0.337305
C 0.862944 -1.985187 -1.373613
C 2.655296 3.082533 0.084180
C -4.284079 -0.395874 0.024917
C 0.868390 -2.834701 -0.114144
C 4.139257 3.090514 -0.240576
C -4.065018 -1.728180 -0.625013
C -0.230285 -3.669776 0.203492
C 2.003340 -2.823053 0.737827
C 4.939804 4.157914 0.238225
C 4.732393 2.073342 -1.025387
C -6.361118 -1.510327 -0.096676
C -0.187844 -4.496418 1.350662
C 2.040241 -3.639661 1.887857
C 6.316525 4.213541 -0.070251
C 6.112183 2.129303 -1.329889
C 0.945782 -4.484215 2.194280
C 6.907907 3.197554 -0.857361
H -1.481089 -1.024089 -0.695854
H -2.208954 2.903342 1.009282
H 0.190623 3.475189 0.766210
H -3.966819 1.509856 0.808756
H 1.666735 -2.293272 -2.064069
H -0.103491 -2.049292 -1.907182
H 2.490120 3.259075 1.167581
H 2.125281 3.877806 -0.482656
H -6.168894 0.419727 0.752193
H -1.123155 -3.659523 -0.432442
H 2.845088 -2.161567 0.501312
H 4.490731 4.948067 0.854406
H 4.110130 1.247143 -1.380250
H -5.528185 -3.247572 -1.052305
H -1.042229 -5.140078 1.588842
H 2.919018 -3.622285 2.542514
H 6.926051 5.043117 0.305250
H 6.564840 1.336709 -1.936443
H 0.976446 -5.122245 3.084965
H 7.976611 3.237985 -1.095876


