%chk=000214337.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214337

0 1
O 4.741914 -1.227008 0.360973
O 4.639222 2.244110 0.036602
O -6.905014 -0.810226 0.165026
O -0.684888 -0.809538 1.718249
O 4.622233 -0.485285 -1.778089
N -1.500549 0.612083 0.091032
C 0.852853 0.685541 0.648146
C 3.155975 0.416168 -0.063924
C 1.887397 -0.125982 0.164376
C -2.886618 0.237424 0.107167
C -0.488708 0.068920 0.902615
C 1.086859 2.036341 0.948897
C 3.376635 1.774335 0.246616
C 2.347718 2.591566 0.750534
C -3.403898 -0.691781 1.037060
C -3.733859 0.838135 -0.840057
C 4.234091 -0.433204 -0.636743
C -5.592797 -0.396774 0.060914
C -4.753241 -1.009597 1.016420
C -5.095850 0.523449 -0.867136
C 5.803614 -2.174045 0.012108
C 5.211004 -3.376910 -0.690713
C -7.861067 -0.257905 -0.770064
H 1.704058 -1.187100 -0.035725
H 0.278383 2.653811 1.348728
H -1.240640 1.305577 -0.613055
H 2.535724 3.634494 0.989438
H -2.740350 -1.164411 1.772588
H -3.343583 1.552084 -1.563124
H -5.177915 -1.723094 1.721595
H -5.740105 0.993593 -1.602916
H 6.555634 -1.647793 -0.601921
H 6.205094 -2.406972 1.015661
H 4.732904 3.206250 0.265912
H 5.956101 -4.169902 -0.825540
H 4.370836 -3.801204 -0.125708
H 4.831574 -3.108599 -1.688285
H -7.936800 0.825513 -0.642614
H -8.789621 -0.755235 -0.459579
H -7.594817 -0.532633 -1.794564


%chk=000214337-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214337

0 1
O 4.268974 -1.654083 0.538109
O 4.676736 2.522507 -0.227335
O -6.996678 -0.908908 0.318270
O -0.444122 -1.180658 1.063126
O 5.731863 -0.027240 -0.270368
N -1.542904 0.592282 -0.018487
C 0.888890 0.682060 0.266178
C 3.355811 0.504159 0.104050
C 2.079006 -0.080052 0.284835
C -2.907333 0.189140 0.076224
C -0.409168 -0.051107 0.481138
C 0.988179 2.088513 0.095146
C 3.431108 1.920746 -0.076225
C 2.243091 2.697542 -0.070058
C -3.331717 -0.973513 0.780578
C -3.878003 1.000193 -0.563644
C 4.578351 -0.358404 0.088189
C -5.664560 -0.480385 0.194137
C -4.698119 -1.294734 0.834933
C -5.249930 0.675799 -0.511833
C 5.390238 -2.639069 0.524908
C 5.519583 -3.299054 -0.851344
C -8.027081 -0.104915 -0.340356
H 2.007021 -1.157504 0.450898
H 0.099510 2.729808 0.136883
H -1.380582 1.436898 -0.570397
H 2.311234 3.787624 -0.180611
H -2.586044 -1.606492 1.263751
H -3.564484 1.898540 -1.112043
H -5.039579 -2.184714 1.372227
H -5.971684 1.323467 -1.017583
H 6.321120 -2.116698 0.807900
H 5.105901 -3.362463 1.305764
H 4.580482 3.504916 -0.320825
H 6.296682 -4.085250 -0.815945
H 4.567320 -3.767998 -1.153844
H 5.813482 -2.558995 -1.614398
H -8.056677 0.925740 0.065098
H -8.975779 -0.615747 -0.119622
H -7.870634 -0.067755 -1.436527


