%chk=000285057.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285057

0 1
O 1.502936 -1.828239 -1.802246
O 6.519516 2.568241 -1.743206
O 4.758844 -1.362978 2.997504
N 4.283109 -0.101365 -0.452657
N 1.476028 0.171892 -0.642182
C -2.192273 -0.625635 -0.311570
C -2.625889 0.413658 0.524782
C -1.672536 1.398624 0.999585
C -0.310246 1.314932 0.620537
C 0.099494 0.224259 -0.256046
C -3.140743 -1.618163 -0.786535
C -0.812567 -0.700121 -0.693397
C -4.498762 -1.519802 -0.399507
C -4.014687 0.482848 0.898335
C 3.585836 -0.650639 -1.653810
C -4.913862 -0.439812 0.457854
C -2.077505 2.466787 1.855457
C 0.606810 2.290941 1.106336
C 5.589062 0.526242 -0.826025
C 4.451015 -1.149564 0.603421
C 2.091989 -0.854100 -1.372148
C -2.748161 -2.695147 -1.634099
C -5.436468 -2.488650 -0.861551
C -1.173627 3.399311 2.310810
C 0.189385 3.310678 1.932062
C 5.317870 1.989742 -1.223284
C 4.354761 -0.449137 1.972434
C -3.668390 -3.622062 -2.070392
C -5.028685 -3.518088 -1.680242
H -0.503695 -1.526101 -1.351538
H -4.333075 1.300512 1.548838
H 3.684827 0.059306 -2.508781
H 4.000826 -1.619943 -2.017411
H 2.081214 0.920550 -0.271118
H -5.963482 -0.382793 0.742573
H -3.128215 2.533893 2.147050
H 6.287220 0.497423 0.038808
H 6.118336 0.006483 -1.654677
H 3.652881 -1.919316 0.521051
H 5.410320 -1.707499 0.535565
H 1.658057 2.228315 0.818338
H -1.698498 -2.774236 -1.933481
H -6.477697 -2.400218 -0.556440
H -1.492046 4.211317 2.963454
H 0.893454 4.054580 2.300491
H 4.615358 2.075085 -2.074056
H 4.942873 2.587956 -0.375930
H 5.081777 0.378064 2.076320
H 3.337550 -0.073288 2.175572
H -3.364150 -4.442933 -2.717718
H -5.739892 -4.261424 -2.036909
H 7.184481 2.685360 -1.036494
H 4.090223 -2.066443 3.119372


%chk=000285057-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000285057

0 1
O 1.552219 -2.041408 -2.061041
O 6.016472 2.868678 -1.932783
O 4.827359 -0.985864 3.259475
N 4.243456 -0.134808 -0.408791
N 1.571650 -0.195280 -0.570176
C -2.160551 -0.697545 -0.356108
C -2.541251 0.366348 0.524920
C -1.514124 1.271789 1.038672
C -0.130668 1.093568 0.660937
C 0.209736 -0.010985 -0.225180
C -3.176109 -1.610692 -0.883163
C -0.780194 -0.861519 -0.710829
C -4.555985 -1.424623 -0.501693
C -3.931029 0.514445 0.877736
C 3.677346 -0.923857 -1.535011
C -4.899743 -0.344612 0.385982
C -1.833649 2.355405 1.918461
C 0.852737 2.005375 1.164312
C 5.384438 0.737047 -0.808995
C 4.524106 -0.977485 0.791207
C 2.148936 -1.130059 -1.412035
C -2.866673 -2.692431 -1.768449
C -5.561506 -2.308427 -1.005584
C -0.854537 3.228289 2.404384
C 0.504402 3.054935 2.020541
C 4.898256 2.071422 -1.413783
C 4.407678 -0.179018 2.107249
C -3.866625 -3.546618 -2.250259
C -5.227416 -3.357116 -1.867812
H -0.466190 -1.665462 -1.376036
H -4.239860 1.320923 1.547948
H 3.856935 -0.386764 -2.485116
H 4.140126 -1.927571 -1.642118
H 2.305014 0.405362 -0.154606
H -5.950760 -0.211885 0.668572
H -2.870295 2.516161 2.225601
H 5.994938 0.949537 0.089215
H 6.054501 0.234093 -1.540930
H 3.785951 -1.802670 0.808606
H 5.533647 -1.443709 0.742391
H 1.905317 1.910657 0.874090
H -1.834328 -2.866055 -2.084758
H -6.603177 -2.148615 -0.702507
H -1.134223 4.047167 3.075681
H 1.272809 3.742317 2.390190
H 4.258373 1.895527 -2.294672
H 4.305238 2.631676 -0.659847
H 5.099160 0.680392 2.112832
H 3.372834 0.203896 2.229898
H -3.600774 -4.366075 -2.926948
H -6.002458 -4.030514 -2.249763
H 6.581560 3.174638 -1.179149
H 4.167832 -1.708678 3.412339


