%chk=000215931.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215931

0 1
O 4.456096 0.710098 0.116961
O 3.176264 2.134086 -1.832607
O 2.945325 -1.350677 1.508133
O -1.501126 -0.768051 -1.906482
N -1.876595 0.179775 0.172341
N -3.827423 0.860735 -1.014778
C 0.399456 -0.003064 -0.639563
C 3.134214 0.447535 -0.203059
C 2.414352 1.206537 -1.166223
C 2.443913 -0.538678 0.529639
C 1.051012 0.984300 -1.387885
C 1.063219 -0.761561 0.314338
C -1.067083 -0.241945 -0.910454
C -3.303207 0.300892 0.111793
C -4.101406 -0.124256 1.213096
C -5.486540 0.032452 1.093151
C -3.492996 -0.718466 2.436302
C -6.037430 0.582228 -0.068711
C -5.176241 0.982037 -1.100480
C 5.381238 0.614482 -1.001966
C 2.527629 2.924072 -2.863729
C 4.357020 -1.256668 1.837799
H 0.494958 1.551964 -2.130016
H 0.563865 -1.541112 0.886654
H -1.438985 0.504312 1.036202
H -6.141066 -0.282118 1.906615
H -2.779553 -1.518578 2.183345
H -2.953675 0.035805 3.026964
H -4.244025 -1.167082 3.101431
H -7.113122 0.696841 -0.171443
H -5.555282 1.422499 -2.030365
H 5.168048 1.410088 -1.726981
H 5.320031 -0.372232 -1.464505
H 6.345837 0.776490 -0.510215
H 3.357257 3.551693 -3.213645
H 2.155684 2.276192 -3.663090
H 1.731247 3.534802 -2.427942
H 4.608280 -0.231903 2.137224
H 4.959369 -1.570478 0.981204
H 4.434841 -1.960046 2.674449


%chk=000215931-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215931

0 1
O 4.537598 0.843664 0.036145
O 3.475121 1.506096 -2.447432
O 2.681887 0.169107 2.212533
O -1.638057 1.669983 -1.722934
N -1.957886 0.312196 0.178116
N -3.977059 1.567849 0.090171
C 0.318697 0.926975 -0.497954
C 3.150159 0.791836 -0.183158
C 2.562326 1.173074 -1.433936
C 2.286305 0.493213 0.910139
C 1.166313 1.228719 -1.592100
C 0.879814 0.573757 0.746093
C -1.167013 1.032534 -0.741967
C -3.366301 0.378549 0.342236
C -4.057571 -0.789113 0.804853
C -5.451437 -0.664953 0.997755
C -3.329386 -2.094287 1.059265
C -6.106577 0.557765 0.721800
C -5.325027 1.641480 0.265699
C 5.398395 0.013936 -0.835625
C 2.923145 2.029121 -3.703116
C 4.017389 -0.382208 2.501016
H 0.693231 1.531752 -2.529735
H 0.272795 0.399858 1.640328
H -1.467828 -0.377610 0.750286
H -6.022775 -1.531434 1.350562
H -2.749000 -2.412388 0.172524
H -2.621963 -2.020676 1.910604
H -4.042000 -2.900005 1.303627
H -7.186558 0.668730 0.856605
H -5.778693 2.613433 0.040625
H 5.307643 0.332836 -1.885914
H 5.130334 -1.056705 -0.736286
H 6.421662 0.181543 -0.466236
H 3.800350 2.275148 -4.319275
H 2.303425 1.269596 -4.216556
H 2.321181 2.939110 -3.522348
H 4.800333 0.380939 2.376584
H 4.239566 -1.249409 1.850310
H 3.950858 -0.711013 3.550201


