%chk=000270067.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270067

0 1
O 6.298980 -0.320011 -0.112253
O 2.692907 -2.050864 1.596034
O 5.344065 1.697910 0.261496
O 0.571937 1.674512 0.656522
N 2.974290 0.079581 0.799556
N -0.013430 -0.248074 1.738386
N -2.389347 -0.260670 0.211319
N -3.038654 2.034446 -1.346526
C 3.448492 -0.058889 -1.682681
C 3.955052 -0.306793 -0.229047
C 2.951672 1.372864 -1.881858
C 2.359647 -1.077359 -2.026234
C 1.246818 -0.303137 2.520546
C 2.361635 -0.879789 1.599925
C 5.219906 0.524203 0.015365
C 1.076693 -1.194517 3.742558
C -0.250235 0.783808 0.848413
C -1.573351 0.785211 0.121424
C 7.619129 0.262509 0.053952
C -3.585493 -0.199279 -0.489171
C -3.913192 0.954539 -1.271833
C -1.900749 1.954569 -0.671759
C -4.501592 -1.299017 -0.430763
C -5.153733 0.993136 -1.983914
C -5.681304 -1.228379 -1.125975
C -6.008914 -0.076473 -1.906037
H 4.323174 -0.232337 -2.362802
H 4.208542 -1.404527 -0.106919
H 2.589008 1.035003 0.720746
H 2.732148 1.573191 -2.935950
H 3.694487 2.114036 -1.554302
H 2.028768 1.577106 -1.318609
H 1.481906 -0.970636 -1.378023
H 2.016846 -0.953194 -3.059892
H 2.716687 -2.108836 -1.919432
H 1.520836 0.742782 2.840537
H 0.218465 -0.896997 4.356406
H 1.970921 -1.152275 4.381825
H 0.955898 -2.254161 3.464512
H -0.666207 -1.028401 1.841428
H 7.858304 0.852536 -0.835324
H 7.646963 0.885998 0.953978
H 8.261642 -0.619323 0.147211
H -1.188999 2.795524 -0.717614
H -4.231908 -2.169739 0.169766
H -5.384811 1.882586 -2.574650
H -6.393852 -2.054289 -1.096139
H -6.959847 -0.066483 -2.441899


%chk=000270067-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270067

0 1
O 6.340167 0.125801 -0.424951
O 2.690436 -2.272537 1.659169
O 5.139217 1.576814 0.945520
O 0.650858 1.759503 0.741690
N 2.896695 -0.103852 0.806883
N -0.058990 -0.290039 1.619716
N -2.400542 -0.134910 0.270011
N -3.005224 2.148966 -1.374769
C 3.651441 -0.356105 -1.600426
C 4.025393 -0.405105 -0.074384
C 3.196910 1.054158 -2.044949
C 2.577152 -1.420251 -1.916625
C 1.131304 -0.511486 2.467279
C 2.316806 -1.061026 1.609808
C 5.184533 0.549606 0.234169
C 0.796353 -1.466414 3.619507
C -0.224674 0.830247 0.851072
C -1.541929 0.897790 0.121959
C 7.537671 0.981147 -0.234649
C -3.604117 -0.056987 -0.412180
C -3.908509 1.096748 -1.240819
C -1.845350 2.038019 -0.701238
C -4.555207 -1.117688 -0.300398
C -5.156636 1.154477 -1.931656
C -5.768493 -1.034427 -0.988127
C -6.070382 0.104149 -1.805537
H 4.582028 -0.616220 -2.142071
H 4.351189 -1.435513 0.162568
H 2.502093 0.848874 0.822730
H 2.971110 1.055957 -3.126762
H 3.976033 1.817371 -1.862653
H 2.281352 1.369824 -1.510646
H 1.629305 -1.188924 -1.396480
H 2.371086 -1.446395 -3.002343
H 2.898019 -2.428623 -1.598457
H 1.432102 0.481761 2.853710
H -0.056634 -1.082180 4.205977
H 1.667024 -1.569857 4.287303
H 0.563692 -2.474574 3.235325
H -0.817189 -0.983155 1.594050
H 7.332983 2.007403 -0.583150
H 7.817441 1.010307 0.831671
H 8.321791 0.503564 -0.838272
H -1.114685 2.847154 -0.785896
H -4.303577 -1.977337 0.328337
H -5.361328 2.034524 -2.548760
H -6.500163 -1.845089 -0.905390
H -7.028359 0.146128 -2.334568


