%chk=000228185.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228185

0 1
N -0.821634 1.474060 0.001558
N 1.435560 1.840623 -0.016196
N -2.011716 -1.509801 0.021767
N 3.462159 -0.467982 -0.020922
N 0.274109 -2.151234 0.006168
N 1.570633 -1.926518 -0.004877
C -0.215633 0.210116 0.002056
C 1.191511 0.465486 -0.009154
C -2.275354 1.738603 0.010331
C -0.662514 -1.159838 0.010113
C 2.096572 -0.659178 -0.011980
C 0.223873 2.430010 -0.009688
C -2.573012 3.218148 0.004352
C -2.413786 -2.938137 0.026101
C 4.391968 -1.622906 -0.026241
C -2.708099 3.910921 1.215966
C -2.724624 3.897757 -1.212747
C -3.918803 -3.028000 0.011516
C 5.813334 -1.120778 -0.008476
C -3.000676 5.277499 1.207283
C -3.017154 5.264373 -1.214896
C -4.633308 -3.065968 1.217675
C -4.609397 -3.071061 -1.208335
C -3.156384 5.954920 -0.006511
C 6.488055 -0.876328 -1.213316
C 6.464278 -0.895134 1.213008
C -6.028159 -3.152489 1.201785
C -6.004275 -3.157544 -1.219596
C 7.808059 -0.417412 -1.194351
C 7.784306 -0.436162 1.227044
C -6.715098 -3.198400 -0.015699
C 8.457835 -0.197894 0.024602
H -2.737614 1.246410 -0.882263
H -2.724992 1.256196 0.914596
H 0.040495 3.497095 -0.012481
H -2.728961 -0.808658 0.029505
H -1.960350 -3.457992 -0.854251
H -1.977811 -3.447618 0.920949
H 3.838458 0.473946 -0.029375
H 4.191950 -2.260932 -0.922615
H 4.176984 -2.280704 0.852511
H -2.582288 3.388849 2.164194
H -2.611684 3.365416 -2.156884
H -3.106387 5.815495 2.149069
H -3.135707 5.792134 -2.160935
H -4.100504 -3.032674 2.167323
H -4.057790 -3.041440 -2.147368
H -3.385022 7.020143 -0.010727
H 5.983063 -1.042813 -2.164071
H 5.940451 -1.076017 2.150917
H -6.580198 -3.187122 2.139731
H -6.537716 -3.196087 -2.168100
H 8.330387 -0.230151 -2.131081
H 8.288118 -0.263464 2.176633
H -7.801230 -3.268826 -0.026269
H 9.486024 0.158557 0.037452


%chk=000228185-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228185

0 1
N -0.659236 1.702998 0.503074
N 1.546869 2.149192 0.071312
N -1.823641 -1.302551 0.329398
N 3.485927 0.014741 -0.833585
N 0.372559 -1.837802 -0.391217
N 1.684323 -1.534527 -0.730071
C -0.063694 0.468147 0.174545
C 1.290445 0.777450 -0.099478
C -2.081150 1.964508 0.840533
C -0.504042 -0.890662 0.053237
C 2.163218 -0.262592 -0.556287
C 0.358079 2.664660 0.432968
C -2.608884 3.261075 0.237155
C -2.200486 -2.714076 0.091639
C 4.427151 -0.982554 -1.357081
C -3.209430 4.239951 1.064345
C -2.540821 3.484770 -1.162282
C -3.707120 -2.898592 0.208510
C 5.731177 -1.043115 -0.567308
C -3.741101 5.425223 0.504472
C -3.066560 4.668354 -1.721767
C -4.240822 -3.976635 0.957299
C -4.602761 -2.017113 -0.452172
C -3.670157 5.642003 -0.889711
C 6.974253 -1.132124 -1.240859
C 5.720316 -1.044074 0.851277
C -5.638291 -4.176799 1.041862
C -5.998835 -2.211128 -0.365794
C 8.184050 -1.229736 -0.515242
C 6.926584 -1.138626 1.578701
C -6.522274 -3.293295 0.381450
C 8.164085 -1.233233 0.898058
H -2.660554 1.109672 0.448330
H -2.201826 1.986104 1.940529
H 0.168190 3.715908 0.634806
H -2.268758 -0.885071 1.151353
H -1.835716 -2.976174 -0.918402
H -1.669416 -3.399684 0.785039
H 3.790257 0.982103 -0.710571
H 4.650977 -0.784562 -2.425779
H 3.894163 -1.950859 -1.313312
H -3.262755 4.077765 2.148140
H -2.071587 2.734168 -1.809702
H -4.203915 6.175730 1.154512
H -3.008363 4.832367 -2.803323
H -3.559184 -4.662870 1.475039
H -4.193330 -1.184389 -1.035984
H -4.078779 6.560348 -1.325370
H 6.995915 -1.124738 -2.338221
H 4.761556 -0.969303 1.377313
H -6.034730 -5.016529 1.623803
H -6.678604 -1.525180 -0.884326
H 9.138058 -1.297346 -1.050642
H 6.904013 -1.140758 2.674613
H -7.605483 -3.445510 0.447124
H 9.100442 -1.305535 1.462849


