%chk=000202903.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202903

0 1
N -2.923980 -0.911893 -0.078502
N -0.269398 0.218131 -0.377604
C -1.733290 -1.783642 -0.351182
C -2.717728 0.429062 -0.717836
C -0.474071 -1.126396 0.248685
C -1.459350 1.091857 -0.124595
C -4.174260 -1.566914 -0.591656
C 1.016853 0.817009 -0.216117
C -5.397077 -0.791272 -0.161221
C 2.161219 0.018128 -0.000499
C 1.192024 2.207427 -0.399348
C 3.435273 0.590554 0.024417
C 3.605337 1.976927 -0.159189
C 2.466676 2.767091 -0.372810
C -5.551701 -0.396642 1.176777
C -6.398897 -0.489342 -1.094883
C 4.606931 -0.292113 0.249627
C 4.966090 2.592660 -0.130086
C -6.699232 0.292219 1.574798
C -7.547621 0.197414 -0.689891
C 5.228627 -0.923115 -0.838266
C 5.091079 -0.499223 1.550015
C -7.700389 0.589004 0.643248
C 6.329427 -1.756527 -0.623031
C 6.191972 -1.334411 1.757727
C 6.812450 -1.963311 0.673280
H -1.574232 -1.975856 -1.435012
H -1.897481 -2.765982 0.141365
H -3.604657 1.061669 -0.490491
H -2.627434 0.371777 -1.824424
H -0.575232 -1.052243 1.354726
H 0.408736 -1.771544 0.036187
H -1.303552 2.079118 -0.615637
H -1.605755 1.279222 0.962753
H -4.231939 -2.587490 -0.142531
H -4.165275 -1.711370 -1.694944
H 2.063403 -1.058802 0.134474
H 0.331533 2.850083 -0.578107
H 2.577676 3.841202 -0.520812
H -4.763259 -0.622989 1.896238
H -6.288777 -0.787362 -2.135111
H 5.613601 2.157644 -0.905784
H 4.945235 3.676623 -0.292080
H 5.461362 2.414327 0.835640
H -6.815130 0.598114 2.613124
H -8.324380 0.427772 -1.416823
H 4.849804 -0.761196 -1.846138
H 4.606184 -0.009082 2.392401
H -8.594723 1.123161 0.956064
H 6.811479 -2.246074 -1.467393
H 6.566909 -1.495624 2.766858
H 7.669440 -2.612681 0.837899


%chk=000202903-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202903

0 1
N -2.923578 -0.880662 -0.122764
N -0.255236 0.251728 -0.190031
C -1.731095 -1.757856 -0.142649
C -2.642187 0.357474 -0.885396
C -0.531814 -1.035373 0.491453
C -1.448151 1.117389 -0.282995
C -4.153456 -1.570332 -0.579889
C 1.021945 0.856502 -0.041859
C -5.427274 -0.799371 -0.244876
C 2.209147 0.070164 -0.003009
C 1.183356 2.270989 0.039715
C 3.501585 0.638081 0.121328
C 3.651714 2.060183 0.185921
C 2.469850 2.837454 0.134975
C -5.564407 -0.148195 1.007581
C -6.508180 -0.758735 -1.159071
C 4.670682 -0.298837 0.162530
C 5.001113 2.758610 0.266963
C -6.760610 0.524614 1.339614
C -7.709380 -0.089191 -0.827939
C 4.796139 -1.336707 -0.802019
C 5.655828 -0.214007 1.184083
C -7.839580 0.554578 0.423849
C 5.869183 -2.253790 -0.750936
C 6.727981 -1.131069 1.239601
C 6.841414 -2.155742 0.271378
H -1.462040 -2.063969 -1.186123
H -1.948601 -2.672890 0.439782
H -3.533997 1.008209 -0.854618
H -2.420694 0.124327 -1.958523
H -0.751540 -0.860180 1.569992
H 0.349178 -1.692302 0.429854
H -1.222355 1.972506 -0.943235
H -1.737760 1.517566 0.717065
H -4.179324 -2.554470 -0.069009
H -4.131390 -1.784031 -1.679518
H 2.143808 -1.020668 -0.062139
H 0.316409 2.937106 0.044877
H 2.558847 3.930492 0.177392
H -4.716307 -0.168200 1.701203
H -6.409682 -1.250246 -2.135514
H 5.787252 2.203098 -0.272904
H 4.936744 3.771977 -0.167730
H 5.349306 2.875645 1.312069
H -6.853899 1.024606 2.310724
H -8.537140 -0.065447 -1.545968
H 4.056722 -1.406092 -1.608494
H 5.566040 0.559724 1.954340
H -8.768193 1.076470 0.681476
H 5.949741 -3.039112 -1.511362
H 7.469877 -1.050512 2.042394
H 7.674509 -2.866408 0.312710


