%chk=000280013.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280013

0 1
O 0.852528 1.814697 0.441463
N -4.937544 -0.434166 -0.105254
N 0.742168 -0.424167 -0.072903
N 2.737294 -1.736891 -0.364883
N 7.113799 0.325335 -0.060094
C -0.709983 -0.390615 -0.056056
C -3.525124 -0.331663 -0.088912
C -1.419976 -0.360711 1.166228
C -2.815931 -0.340044 1.135847
C -5.664016 -0.100645 -1.364547
C -5.693485 -0.115769 1.140504
C -1.400216 -0.360599 -1.277255
C -2.788580 -0.339188 -1.301061
C 1.417292 -1.646732 -0.312877
C 1.475741 0.805465 0.180085
C 2.924694 0.669756 0.096690
C 3.529361 -0.588951 -0.172817
C -0.693726 -0.327217 2.468927
C -5.623405 1.376786 -1.752712
C -5.668880 1.358172 1.542928
C 0.599837 -2.879494 -0.513193
C 3.748192 1.803776 0.289350
C 4.927002 -0.706038 -0.252465
C 5.720595 0.433925 -0.053630
C 5.121120 1.703075 0.213777
H -3.358040 -0.326580 2.079167
H -6.719364 -0.434963 -1.244443
H -5.234114 -0.724173 -2.183453
H -5.278073 -0.744588 1.962997
H -6.744049 -0.454378 0.993887
H -0.841671 -0.348666 -2.214501
H -3.301359 -0.326626 -2.259463
H -1.358268 -0.421381 3.335740
H 0.060255 -1.122723 2.543318
H -0.156421 0.634030 2.572184
H -6.081736 2.010059 -0.978380
H -4.593742 1.735521 -1.884341
H -6.158147 1.556098 -2.691083
H -4.643987 1.719582 1.703087
H -6.110681 1.996944 0.763657
H -6.226941 1.526630 2.469631
H 3.267292 2.765598 0.497374
H -0.115280 -3.036181 0.309912
H 1.239786 -3.777308 -0.574866
H 0.016034 -2.830746 -1.445687
H 5.363113 -1.681528 -0.454284
H 5.747114 2.576039 0.368578
H 7.670840 1.158476 -0.142820
H 7.537282 -0.506233 -0.437348


%chk=000280013-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000280013

0 1
O 0.885025 1.883734 0.439620
N -4.939160 -0.188091 -0.122358
N 0.779502 -0.419176 -0.050077
N 2.762650 -1.765842 -0.352765
N 7.176249 0.284955 -0.198783
C -0.675782 -0.353109 -0.043902
C -3.535483 -0.214731 -0.101545
C -1.397021 -0.314857 1.178377
C -2.805616 -0.248992 1.130868
C -5.672549 -0.065892 -1.398539
C -5.717790 -0.139626 1.131145
C -1.368639 -0.295282 -1.269798
C -2.770887 -0.225534 -1.312843
C 1.442923 -1.644057 -0.284367
C 1.506531 0.809257 0.182796
C 2.961572 0.669568 0.088324
C 3.550296 -0.609562 -0.182081
C -0.671117 -0.307031 2.509678
C -5.706867 1.364802 -1.991746
C -5.813599 1.262574 1.783320
C 0.594993 -2.882936 -0.457048
C 3.806947 1.798699 0.261908
C 4.956160 -0.735002 -0.275575
C 5.791762 0.396787 -0.105527
C 5.195128 1.675081 0.167132
H -3.339345 -0.209640 2.084819
H -6.708196 -0.410509 -1.221520
H -5.238596 -0.766997 -2.137976
H -5.287955 -0.859483 1.854361
H -6.736911 -0.504980 0.904814
H -0.797179 -0.285966 -2.205029
H -3.260877 -0.170937 -2.287943
H -1.376150 -0.408612 3.351973
H 0.070696 -1.124312 2.580526
H -0.118306 0.642882 2.632421
H -6.235370 2.060929 -1.317151
H -4.686753 1.755484 -2.148887
H -6.231282 1.364160 -2.965839
H -4.811361 1.674421 1.993280
H -6.339507 1.972806 1.121351
H -6.370817 1.205145 2.737363
H 3.336349 2.765649 0.468824
H -0.109205 -3.013137 0.384093
H 1.270219 -3.748567 -0.516760
H -0.015611 -2.834878 -1.376200
H 5.372047 -1.726940 -0.481423
H 5.839131 2.552824 0.299620
H 7.773617 1.096888 -0.073799
H 7.614734 -0.610965 -0.391132


