%chk=000266552.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266552

0 1
O -4.980925 0.387376 -0.696482
O -1.853707 3.166499 0.057109
O -5.577093 -1.650735 -1.205256
N -0.311013 1.489740 0.002026
N 2.239723 -1.059247 -0.080561
C -2.314625 -0.431559 -0.116034
C -3.383391 -1.486024 -0.197117
C 0.024704 0.123538 -0.056597
C -2.655275 0.895189 -0.058789
C 0.900524 2.377695 0.048024
C 2.037684 1.393801 0.018512
C 1.505486 0.034988 -0.043515
C -0.939843 -0.840597 -0.114404
C -1.664318 1.965732 0.001530
C -3.606072 -2.183531 1.164090
C -4.084904 1.329788 -0.052551
C -4.712283 -0.961269 -0.722240
C 3.386855 1.577318 0.039772
C 4.229567 0.412888 0.000138
C 3.627674 -0.879782 -0.059139
C -4.134390 -1.253589 2.248355
C 5.652598 0.506932 0.018012
C 4.451531 -2.049030 -0.099367
C 6.423979 -0.630421 -0.021407
C 5.818404 -1.918457 -0.080599
H -3.052682 -2.276309 -0.932495
H 0.881540 3.000479 0.970819
H 0.897800 3.072258 -0.822532
H -0.669763 -1.895008 -0.157675
H -2.649211 -2.639534 1.491277
H -4.314570 -3.026987 1.014892
H -4.472618 1.464296 0.976474
H -4.255231 2.253831 -0.647471
H 3.841994 2.566137 0.085075
H -3.452762 -0.415238 2.437198
H -5.113891 -0.832765 1.986258
H -4.260716 -1.789826 3.197449
H 6.113590 1.493573 0.063003
H 3.964655 -3.025699 -0.145011
H 7.512432 -0.564667 -0.008241
H 6.461144 -2.799187 -0.111028


%chk=000266552-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266552

0 1
O -5.013182 0.388969 -0.741403
O -1.868970 3.213194 0.070789
O -5.625898 -1.757867 -1.185255
N -0.307666 1.470169 -0.009610
N 2.247724 -1.069785 -0.113343
C -2.310999 -0.448250 -0.158572
C -3.408799 -1.496944 -0.201438
C 0.041750 0.120954 -0.083818
C -2.646281 0.905098 -0.091488
C 0.870546 2.376581 0.064230
C 2.025053 1.397123 0.027647
C 1.509703 0.050170 -0.061323
C -0.936077 -0.858456 -0.160903
C -1.638089 1.960045 -0.008778
C -3.630608 -2.188234 1.192259
C -4.082570 1.356665 -0.101666
C -4.752620 -0.986511 -0.740638
C 3.398549 1.586307 0.064682
C 4.246392 0.425666 0.012503
C 3.626920 -0.889858 -0.076956
C -4.132217 -1.243584 2.303773
C 5.674076 0.516397 0.045480
C 4.460004 -2.052033 -0.129847
C 6.461997 -0.636565 -0.007393
C 5.850930 -1.928096 -0.095617
H -3.110832 -2.304480 -0.897916
H 0.820715 2.980630 0.988907
H 0.851266 3.083319 -0.785915
H -0.640071 -1.907658 -0.226513
H -2.669885 -2.646203 1.496628
H -4.353881 -3.010289 1.039347
H -4.459361 1.544038 0.922689
H -4.191282 2.292123 -0.673538
H 3.847749 2.583786 0.131939
H -3.425561 -0.411887 2.477646
H -5.121183 -0.817033 2.053991
H -4.240773 -1.795584 3.254141
H 6.143090 1.505365 0.112978
H 3.966522 -3.026139 -0.197726
H 7.553972 -0.556603 0.018194
H 6.482451 -2.821942 -0.136669


