%chk=000223541.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223541

0 1
O 2.694256 0.534558 0.096272
O -2.372439 2.519218 0.212194
O -3.954938 -1.810625 -0.109244
N 0.480113 1.309893 0.156767
N -1.668121 -1.561458 -0.070116
N -3.165726 0.361580 0.051279
N 0.768673 -0.985413 -0.006635
C -0.806325 0.716859 0.098232
C -0.590390 -0.685255 0.001115
C 1.382456 0.255196 0.083051
C 3.642772 -0.633143 0.089248
C -2.102899 1.335699 0.130061
C 4.935992 0.068013 -0.330041
C -3.007109 -1.050109 -0.046946
C 0.754378 2.744909 0.237660
C 3.672155 -1.212879 1.487920
C -1.440619 -3.023041 -0.173106
C -4.573153 0.847954 0.069991
C 5.111596 0.095760 -1.843473
H 3.266041 -1.357803 -0.664081
H 4.930179 1.107291 0.068634
H 5.804495 -0.427381 0.147938
H 1.364937 2.975437 1.129556
H 1.297304 3.093003 -0.660050
H -0.201096 3.312575 0.309025
H 3.897795 -0.452855 2.246295
H 2.697528 -1.653222 1.754510
H 4.418145 -2.011393 1.578996
H -2.409224 -3.554168 -0.248180
H -0.899640 -3.388870 0.717351
H -0.835046 -3.252718 -1.067839
H -4.588080 1.949601 0.174333
H -5.123779 0.400521 0.915323
H -5.088669 0.570444 -0.865408
H 4.263280 0.589486 -2.335897
H 5.196448 -0.912380 -2.265965
H 6.017112 0.645615 -2.127171


%chk=000223541-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223541

0 1
O 2.698601 0.536259 0.141286
O -2.402777 2.579785 0.104640
O -3.958319 -1.871443 -0.110573
N 0.471017 1.330748 0.127287
N -1.634333 -1.546917 -0.040320
N -3.154241 0.328798 -0.005209
N 0.763385 -0.948971 0.049121
C -0.815659 0.746416 0.068161
C -0.589762 -0.638293 0.021462
C 1.363147 0.273908 0.111060
C 3.627529 -0.663653 0.156561
C -2.122219 1.338202 0.060839
C 4.969260 -0.135126 -0.367130
C -2.972717 -1.080040 -0.055909
C 0.799534 2.763917 0.181699
C 3.685223 -1.226354 1.581282
C -1.367613 -2.996477 -0.089486
C -4.562247 0.787102 -0.021797
C 4.922310 0.326981 -1.837781
H 3.189553 -1.406867 -0.536675
H 5.299752 0.695918 0.285671
H 5.712200 -0.948611 -0.249297
H 1.402096 2.982316 1.079355
H 1.373890 3.060575 -0.712622
H -0.146727 3.324954 0.218302
H 4.072670 -0.469098 2.285683
H 2.686416 -1.554970 1.913004
H 4.358833 -2.102461 1.608660
H -2.338466 -3.509411 -0.149700
H -0.825539 -3.314649 0.817123
H -0.752151 -3.238514 -0.972157
H -4.547615 1.885939 0.022316
H -5.106179 0.371420 0.842179
H -5.061931 0.442434 -0.941922
H 4.187333 1.140009 -1.968454
H 4.635368 -0.503792 -2.509377
H 5.908776 0.700868 -2.165682


