%chk=000191831.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191831

0 1
O 1.245445 0.046520 1.355262
O 3.768794 -1.547167 0.193413
O 2.145537 1.963968 -0.878223
O -1.808915 -2.263430 0.710315
N -0.759087 -0.281795 0.186212
N 0.939966 -0.774946 -1.990358
N -3.190109 -0.528664 0.012426
N -4.487163 1.238451 -0.773906
C 1.485078 -1.236213 -0.701042
C 2.850669 -0.581648 -0.332594
C 0.549376 -0.895741 0.505243
C 2.563890 0.358156 0.854467
C 2.605686 1.847444 0.488859
C -0.845627 1.019280 -0.265630
C -1.985128 -1.131264 0.322362
C -2.065929 1.575921 -0.567984
C -3.238892 0.754154 -0.428224
H 1.592693 -2.352762 -0.736590
H 3.327141 -0.060604 -1.189733
H 0.367044 -1.795911 1.154086
H 3.237924 0.140386 1.720432
H 3.630730 2.251532 0.558872
H 1.919054 2.424433 1.139255
H 1.444622 -1.183001 -2.770023
H 0.991406 0.239669 -2.075523
H 4.037804 -2.185881 -0.496859
H 0.092255 1.593277 -0.362597
H 2.289544 2.877065 -1.198932
H -2.142354 2.596515 -0.916881
H -5.306647 0.671339 -0.603674
H -4.630408 2.215915 -0.944632


%chk=000191831-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191831

0 1
O 1.240235 0.593661 1.068340
O 3.307523 -1.876224 0.622698
O 2.686535 2.102479 -1.000511
O -1.474103 -2.396807 0.323416
N -0.835475 -0.146195 0.170535
N 1.195904 -0.230798 -1.971455
N -3.143891 -0.810155 -0.172390
N -4.741279 0.770377 -0.748228
C 1.394870 -0.997638 -0.750445
C 2.829235 -0.756078 -0.202677
C 0.531895 -0.563307 0.499569
C 2.688827 0.433659 0.785660
C 3.252094 1.772766 0.321146
C -1.125735 1.151645 -0.182928
C -1.849001 -1.205463 0.114822
C -2.417670 1.517125 -0.521337
C -3.422059 0.478549 -0.475500
H 1.207015 -2.067202 -0.948616
H 3.518854 -0.544362 -1.040874
H 0.467741 -1.393290 1.225510
H 3.201086 0.144912 1.724535
H 4.358057 1.692200 0.265376
H 2.978846 2.549037 1.063584
H 0.310738 -0.385189 -2.456216
H 1.511456 0.745992 -1.922028
H 3.349487 -2.694259 0.066289
H -0.289637 1.853086 -0.137246
H 3.011050 2.987747 -1.295365
H -2.655135 2.549573 -0.784880
H -5.414545 0.007536 -0.697618
H -5.048520 1.711622 -0.975366


