%chk=000268030.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268030

0 1
O 0.382440 -0.711522 -1.793810
O -4.616024 -0.464726 -1.582419
N -4.424531 -0.343794 0.668831
C 0.644705 -0.371117 -0.415033
C -0.235993 -1.285100 0.477282
C 0.416746 1.123772 -0.230095
C 2.111352 -0.735842 -0.202011
C -1.696791 -0.947647 0.502528
C -0.006532 1.670413 0.987373
C 2.765164 -1.568897 -1.119695
C 0.679348 1.974165 -1.315641
C 2.803337 -0.254850 0.918591
C -2.439106 -0.883406 -0.645206
C -2.332014 -0.724035 1.772965
C -0.180124 3.052681 1.113103
C 4.102620 -1.920372 -0.916180
C 0.503400 3.353467 -1.188426
C 4.139435 -0.611101 1.119437
C 0.071607 3.895507 0.026889
C 4.790703 -1.444618 0.203969
C -3.848225 -0.567517 -0.644242
C -3.669446 -0.428544 1.828076
H -0.116803 -2.329120 0.097443
H 0.190083 -1.309980 1.501604
H -0.208636 1.027991 1.842439
H 2.224824 -1.932271 -1.998215
H 1.027323 1.546806 -2.259552
H 2.308899 0.406654 1.628560
H -0.545314 -0.467814 -2.039701
H -2.004964 -1.075040 -1.630074
H -1.746965 -0.795510 2.684804
H -0.512926 3.471900 2.060717
H 4.607741 -2.564921 -1.633591
H 0.705164 4.006763 -2.035921
H 4.675350 -0.234769 1.988847
H -0.066264 4.970622 0.126020
H 5.831815 -1.719321 0.362143
H -4.187092 -0.250251 2.777967
H -5.420204 -0.117554 0.716024


%chk=000268030-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268030

0 1
O 0.213126 -0.440811 -1.698062
O -4.506633 -2.259685 -1.623282
N -4.490147 -0.673070 0.097785
C 0.629661 -0.188664 -0.302869
C -0.234583 -1.119588 0.646109
C 0.471290 1.310387 0.029792
C 2.098875 -0.663068 -0.231270
C -1.735962 -0.970872 0.462550
C 0.424947 1.793045 1.363811
C 2.478629 -1.814368 -0.968756
C 0.420151 2.252327 -1.028420
C 3.065251 -0.023858 0.582168
C -2.397324 -1.719375 -0.514429
C -2.493716 -0.047108 1.273938
C 0.312907 3.175397 1.632865
C 3.794521 -2.317331 -0.889540
C 0.305350 3.635119 -0.762848
C 4.382617 -0.531201 0.666064
C 0.248311 4.104190 0.569276
C 4.752770 -1.680889 -0.066033
C -3.831740 -1.616098 -0.760312
C -3.857731 0.073354 1.070822
H 0.065029 -2.154926 0.408024
H 0.054205 -0.930686 1.694589
H 0.486128 1.095334 2.207316
H 1.742329 -2.287074 -1.625656
H 0.478312 1.885688 -2.057735
H 2.804733 0.882749 1.136572
H -0.775279 -0.340751 -1.751583
H -1.864488 -2.458703 -1.120216
H -2.008227 0.558714 2.040193
H 0.280409 3.525401 2.671042
H 4.073723 -3.202324 -1.472599
H 0.265686 4.345654 -1.596297
H 5.119551 -0.021667 1.297245
H 0.160296 5.176651 0.775847
H 5.774978 -2.070868 -0.003642
H -4.483488 0.750727 1.658399
H -5.500367 -0.590652 -0.055061


