%chk=000205915.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205915

0 1
O 1.677656 4.129357 -0.159991
O 2.347839 -4.304422 0.438722
O 0.253443 -3.931758 0.828656
N -0.662647 1.947384 0.936694
N 2.167138 1.947916 -0.585019
N 1.373631 -3.570543 0.505524
C -0.553851 1.016135 -0.231940
C -1.319917 1.298125 2.117049
C -1.853319 0.272007 -0.483191
C -2.781728 1.013104 1.744523
C 0.635133 0.068966 -0.130479
C -2.898633 0.254683 0.454671
C 0.655639 2.527210 1.336494
C 1.946552 0.556103 -0.379363
C 1.487250 2.971333 0.140957
C -2.007209 -0.401711 -1.706468
C 0.464056 -1.280436 0.173037
C -4.080255 -0.448288 0.165906
C 3.043393 -0.333860 -0.412440
C 1.568285 -2.148306 0.177214
C -3.182918 -1.097387 -1.986626
C -4.220430 -1.122711 -1.046634
C 3.165716 2.363200 -1.605265
C 2.856196 -1.681685 -0.136387
H -0.396092 1.694189 -1.127112
H -1.285074 1.999388 2.978713
H -0.812750 0.360797 2.433794
H -3.330298 1.977155 1.632815
H -3.276863 0.471685 2.574890
H 1.265542 1.861892 1.989702
H 0.421825 3.446478 1.935910
H -1.202528 -0.383576 -2.440846
H -0.535041 -1.683613 0.397820
H -4.891765 -0.465238 0.891437
H 4.044694 0.036141 -0.634029
H -3.294311 -1.620327 -2.934767
H -5.137602 -1.668563 -1.263674
H 2.974886 3.414699 -1.906647
H 3.096388 1.733416 -2.505855
H 4.189540 2.313679 -1.199432
H 3.699526 -2.382617 -0.148364


%chk=000205915-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000205915

0 1
O 1.674395 4.186425 -0.169534
O 2.498720 -4.348936 0.533707
O 0.270436 -3.998798 0.884952
N -0.655764 1.912146 0.943119
N 2.142569 1.949083 -0.637820
N 1.453953 -3.586515 0.568147
C -0.565755 1.004619 -0.242670
C -1.308173 1.278956 2.116474
C -1.890472 0.291865 -0.506157
C -2.780472 0.989686 1.785743
C 0.636389 0.044767 -0.132905
C -2.932340 0.265003 0.456829
C 0.656656 2.508992 1.306096
C 1.953610 0.560808 -0.365828
C 1.488386 2.967373 0.101463
C -2.073909 -0.357453 -1.753293
C 0.492324 -1.320120 0.184944
C -4.136255 -0.419363 0.148452
C 3.075058 -0.313693 -0.365446
C 1.626151 -2.158657 0.227292
C -3.274251 -1.032151 -2.052481
C -4.313467 -1.065018 -1.092097
C 3.154012 2.370425 -1.635639
C 2.920200 -1.675850 -0.067235
H -0.364466 1.662956 -1.112128
H -1.244196 1.987471 2.962299
H -0.785653 0.341091 2.430185
H -3.324197 1.953232 1.734657
H -3.241325 0.398753 2.600239
H 1.284082 1.800190 1.903847
H 0.474816 3.407661 1.918317
H -1.264817 -0.333839 -2.494009
H -0.497305 -1.752094 0.357736
H -4.940071 -0.442804 0.894790
H 4.073445 0.083018 -0.571489
H -3.400499 -1.527441 -3.021160
H -5.249644 -1.590557 -1.310202
H 2.892381 3.386720 -1.968006
H 3.147159 1.676458 -2.491121
H 4.168958 2.407623 -1.197302
H 3.770428 -2.362030 -0.042768


