%chk=000224642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224642

0 1
O 3.168064 -2.284340 1.406803
O 4.744313 0.173543 0.859457
N -0.404027 -0.685712 -1.250537
N -5.164063 0.431561 0.890474
N 1.058521 1.556388 -2.024393
C -1.201051 -1.930912 -1.084434
C -2.700047 -1.594517 -1.232657
C -3.217975 -0.741281 -0.070482
C -4.728895 -0.487258 -0.204393
C -0.773971 -2.978494 -2.121970
C 0.882147 -0.540495 -0.768825
C -6.615952 0.780394 0.834547
C 1.631593 0.667662 -1.130216
C 1.485751 -1.473637 0.070585
C 2.919547 0.885723 -0.570995
C -6.864821 1.894854 1.861016
C -7.551098 -0.413696 1.099321
C 2.770882 -1.234794 0.621824
C 3.472077 -0.062026 0.340426
C 3.626665 2.064536 -0.975344
C 3.047453 2.939003 -1.857874
C 1.739849 2.646642 -2.365499
C 4.726539 1.037870 2.030487
C 4.522407 -2.291362 1.929258
H -1.011583 -2.336889 -0.052717
H -2.888398 -1.080638 -2.195811
H -3.271642 -2.542312 -1.289890
H -2.680993 0.230956 -0.035531
H -2.994259 -1.232316 0.895784
H -5.280710 -1.452092 -0.210791
H -4.944240 0.011744 -1.175455
H -0.751204 -0.000689 -1.925986
H -0.963270 -2.645098 -3.148435
H 0.301657 -3.191361 -2.050595
H -1.303390 -3.925616 -1.977259
H -4.926612 0.030727 1.802663
H -6.825172 1.180930 -0.192615
H 0.993198 -2.405501 0.337944
H -7.874910 2.303324 1.762728
H -6.745864 1.544119 2.891057
H -6.153338 2.719543 1.716550
H -7.375194 -0.860282 2.082915
H -8.600977 -0.103465 1.070951
H -7.424689 -1.201177 0.350387
H 4.630155 2.222984 -0.575755
H 3.556345 3.841424 -2.187353
H 1.260773 3.333355 -3.071632
H 4.167842 0.562291 2.840412
H 5.790256 1.126963 2.270599
H 4.292100 2.008897 1.780270
H 4.580314 -1.607978 2.780175
H 5.243605 -2.008133 1.152954
H 4.641190 -3.336162 2.236254


%chk=000224642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224642

0 1
O 3.622442 -2.020601 1.541779
O 4.808009 0.561982 0.849395
N -0.365048 -0.872466 -1.032167
N -5.231157 0.422650 0.837587
N 0.733723 1.479640 -1.781564
C -1.131921 -2.101400 -0.785341
C -2.641144 -1.807701 -0.970320
C -3.220781 -0.819816 0.066027
C -4.704899 -0.491297 -0.196106
C -0.666528 -3.264084 -1.701029
C 0.904635 -0.606547 -0.566585
C -6.578956 1.002589 0.608240
C 1.489978 0.669276 -0.957475
C 1.668857 -1.469332 0.246938
C 2.799863 1.045008 -0.477252
C -6.848846 2.071044 1.687545
C -7.731696 -0.041632 0.560597
C 2.964242 -1.092052 0.701160
C 3.527683 0.157784 0.378318
C 3.301968 2.322662 -0.889055
C 2.525874 3.134981 -1.720806
C 1.241935 2.674058 -2.148382
C 4.835371 0.848478 2.303682
C 4.948644 -2.476263 1.064209
H -0.967176 -2.399221 0.272666
H -2.802965 -1.414016 -1.997181
H -3.188954 -2.769380 -0.918513
H -2.644302 0.123416 0.070488
H -3.114995 -1.256765 1.081817
H -5.277077 -1.450359 -0.286123
H -4.797530 0.021163 -1.175663
H -0.747345 -0.139760 -1.641792
H -0.898126 -3.037438 -2.758040
H 0.423253 -3.422159 -1.618350
H -1.175838 -4.206961 -1.427475
H -5.149421 0.020536 1.783138
H -6.534863 1.509143 -0.378406
H 1.302451 -2.453211 0.550248
H -7.820158 2.570424 1.519128
H -6.877904 1.610289 2.695031
H -6.048963 2.831124 1.680690
H -7.839669 -0.544490 1.541632
H -8.695979 0.444289 0.319464
H -7.544157 -0.817147 -0.204579
H 4.294662 2.628881 -0.545878
H 2.886632 4.113943 -2.051914
H 0.616378 3.291940 -2.802852
H 4.555265 -0.051024 2.882349
H 5.872117 1.143376 2.530230
H 4.143554 1.677712 2.546103
H 5.629601 -1.621426 0.907464
H 4.834506 -3.042334 0.120055
H 5.329653 -3.140307 1.855264


