%chk=000292155.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292155

0 1
O 3.663051 -0.921341 -0.534174
O 0.935576 -2.265810 0.946343
O 2.940304 0.812936 -1.796197
O 1.389154 -0.172078 1.709116
O -3.315022 0.253795 2.441881
O -1.861459 -1.244170 1.883029
N -2.518070 -0.248159 1.668150
C 0.186855 0.232790 -1.232393
C -1.030296 -0.610927 -1.544925
C -0.099709 1.404970 -0.320015
C -2.381223 0.473701 0.311475
C 1.329429 -0.682227 -0.704917
C -2.218687 -0.518445 -0.807931
C -1.283988 1.501072 0.424192
C -0.965230 -1.504045 -2.631116
C 0.840909 2.447931 -0.240979
C -3.316720 -1.334253 -1.138601
C -1.498510 2.602635 1.272666
C 2.692810 -0.127832 -1.078149
C 1.231674 -0.940366 0.795374
C -2.054568 -2.310166 -2.954551
C 0.623750 3.539427 0.597523
C -3.233570 -2.230311 -2.201710
C -0.545795 3.614129 1.365222
C 5.065359 -0.524671 -0.716832
C 0.688251 -2.772152 2.302695
C 5.395193 0.610073 0.226692
C 1.993166 -2.895543 3.057649
H 0.550087 0.671417 -2.213098
H -3.358334 1.026910 0.157313
H 1.244197 -1.690756 -1.217118
H -0.055412 -1.567127 -3.228300
H 1.755991 2.400633 -0.840230
H -4.238367 -1.269824 -0.559504
H -2.411812 2.658004 1.869642
H -1.990862 -3.003091 -3.793295
H 1.366761 4.334133 0.658958
H -4.083238 -2.865524 -2.449347
H -0.709488 4.459959 2.031495
H 5.574144 -1.472634 -0.460899
H 5.219870 -0.263611 -1.778347
H -0.037318 -2.094501 2.793660
H 0.216901 -3.743836 2.068531
H 4.914129 1.548578 -0.086331
H 5.044906 0.399187 1.247787
H 6.475089 0.792911 0.276399
H 2.423930 -1.903932 3.267405
H 2.741184 -3.458147 2.485217
H 1.851908 -3.402913 4.019045


%chk=000292155-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292155

0 1
O 3.644265 -0.851861 -0.230841
O 0.999998 -2.454478 0.980277
O 2.953731 0.601660 -1.913351
O 1.226460 -0.264605 1.763765
O -3.102860 0.263479 2.642934
O -1.736028 -1.346840 1.795897
N -2.414937 -0.268077 1.697044
C 0.155616 0.208235 -1.228360
C -1.099810 -0.594268 -1.566554
C -0.127949 1.441893 -0.370943
C -2.417218 0.521638 0.305932
C 1.282576 -0.750136 -0.667145
C -2.309166 -0.448161 -0.842939
C -1.337641 1.584918 0.359066
C -1.066590 -1.498128 -2.658817
C 0.806761 2.508678 -0.343412
C -3.452045 -1.202597 -1.212205
C -1.576551 2.753645 1.125238
C 2.687191 -0.223067 -1.007477
C 1.169157 -1.086712 0.823994
C -2.199467 -2.254383 -3.018246
C 0.569646 3.666582 0.423117
C -3.403476 -2.108917 -2.287924
C -0.625014 3.789390 1.171310
C 5.075853 -0.464904 -0.460867
C 0.867015 -2.953538 2.386964
C 5.433066 0.771477 0.366736
C 2.247651 -3.218561 2.991594
H 0.588078 0.571320 -2.182856
H -3.415967 0.989220 0.348326
H 1.195868 -1.711315 -1.210223
H -0.143314 -1.598717 -3.243267
H 1.721987 2.427105 -0.937970
H -4.384325 -1.075878 -0.648090
H -2.511270 2.838827 1.690905
H -2.150931 -2.944548 -3.867476
H 1.309092 4.474982 0.431126
H -4.291012 -2.688303 -2.562993
H -0.815792 4.686344 1.769973
H 5.633535 -1.358112 -0.138282
H 5.221030 -0.290277 -1.541366
H 0.297417 -2.207249 2.964381
H 0.272133 -3.873681 2.275087
H 4.878691 1.657019 0.013973
H 5.202247 0.609833 1.433211
H 6.514706 0.980654 0.271268
H 2.818773 -2.279855 3.087541
H 2.824370 -3.925556 2.370283
H 2.131352 -3.657377 4.000163


