%chk=000280492.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280492

0 1
O -0.942076 -2.304257 -0.218652
O -4.080173 3.326041 0.599620
O -2.781148 1.832326 1.629720
N 4.649507 0.720429 0.915085
N -0.862004 -0.364888 1.044254
C 3.228731 0.632275 0.997442
C 2.794348 -0.564685 0.329457
C 5.096995 -0.341459 0.086499
C 3.977168 -1.181474 -0.246408
C 5.413663 1.957675 1.164711
C 1.449329 -0.922434 0.329030
C 2.315849 1.469289 1.647864
C 6.394534 -0.654900 -0.340922
C 0.541303 -0.078645 0.986261
C 4.179476 -2.340600 -0.995506
C 0.972801 1.107078 1.635731
C 5.350266 2.934631 -0.008021
C 6.560470 -1.816994 -1.091748
C 5.473443 -2.650598 -1.415288
C -1.506449 -1.447985 0.436164
C -2.989332 -1.459340 0.701947
C -3.858568 -0.613084 -0.003084
C -3.353858 0.311138 -1.047832
C -3.492241 -2.351017 1.656971
C -5.235704 -0.658808 0.262185
C -3.129291 1.674400 -0.782344
C -3.122500 -0.182519 -2.340363
C -4.864966 -2.393070 1.915172
C -5.734104 -1.545674 1.219800
C -2.719002 2.538353 -1.809665
C -2.692322 0.675981 -3.354843
C -2.499379 2.037452 -3.093675
C -3.277037 2.212116 0.588912
H 5.014396 2.433248 2.090304
H 6.470632 1.676137 1.380203
H 1.115424 -1.836680 -0.172027
H 2.641913 2.374742 2.150879
H 7.237525 -0.019675 -0.094273
H 3.337746 -2.985466 -1.243723
H 0.243337 1.744308 2.135765
H 5.756573 2.490329 -0.926323
H 5.921394 3.845404 0.201186
H 4.317340 3.232103 -0.231157
H 7.556757 -2.089790 -1.439359
H 5.649329 -3.549523 -2.001271
H -1.443523 0.330348 1.549857
H -2.810623 -3.013551 2.193744
H -5.914831 -0.003616 -0.283218
H -3.270159 -1.245393 -2.545018
H -5.256787 -3.086865 2.658194
H -6.804353 -1.577938 1.423631
H -2.572666 3.599372 -1.597899
H -2.505652 0.281532 -4.355100
H -2.173374 2.705423 -3.890457
H -4.185232 3.711396 1.513887


%chk=000280492-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280492

0 1
O -0.922404 -2.695846 0.063291
O -3.724813 3.623620 0.827529
O -2.750821 1.725660 1.723125
N 4.593019 0.825429 0.675675
N -0.887803 -0.467028 0.845105
C 3.196524 0.668088 0.784496
C 2.825912 -0.620284 0.266527
C 5.126961 -0.331058 0.073380
C 4.056409 -1.257597 -0.187011
C 5.351075 2.024384 1.050705
C 1.477555 -1.037473 0.272248
C 2.225679 1.550368 1.305353
C 6.466720 -0.634186 -0.254362
C 0.501178 -0.152889 0.795404
C 4.345253 -2.507904 -0.779859
C 0.883455 1.127981 1.306317
C 5.463465 3.056976 -0.094094
C 6.729260 -1.889893 -0.844934
C 5.682807 -2.818988 -1.106029
C -1.516282 -1.647387 0.475144
C -3.016316 -1.606071 0.670032
C -3.830917 -0.577877 0.117421
C -3.330685 0.401720 -0.910848
C -3.605592 -2.629766 1.451612
C -5.218788 -0.567758 0.417825
C -3.225621 1.806107 -0.672799
C -3.115036 -0.068569 -2.230590
C -4.986218 -2.612868 1.738531
C -5.792501 -1.566424 1.233563
C -2.979524 2.705545 -1.744127
C -2.827596 0.823306 -3.287059
C -2.781087 2.216946 -3.049903
C -3.218309 2.327754 0.716716
H 4.862264 2.481903 1.930528
H 6.358232 1.708527 1.379181
H 1.170418 -2.015443 -0.102622
H 2.491044 2.536403 1.700218
H 7.282258 0.072009 -0.065000
H 3.542136 -3.225173 -0.982093
H 0.109203 1.789607 1.713498
H 5.972968 2.618706 -0.970041
H 6.041029 3.939004 0.238752
H 4.463746 3.397656 -0.416111
H 7.760060 -2.152640 -1.109222
H 5.921774 -3.783983 -1.565823
H -1.502250 0.262040 1.245149
H -2.962225 -3.428125 1.835408
H -5.851867 0.213993 -0.017652
H -3.190369 -1.143691 -2.423774
H -5.428727 -3.404106 2.353225
H -6.865283 -1.539919 1.454316
H -2.921274 3.777380 -1.533034
H -2.656897 0.431497 -4.295623
H -2.579041 2.912073 -3.871265
H -3.629262 3.930864 1.769900


