%chk=000184335.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184335

0 1
O 1.474277 -0.356564 -0.516801
O 2.461273 0.750299 1.184268
O -4.279627 1.051063 -0.009322
N 6.859524 0.325843 0.358114
N 1.106427 1.925885 -2.908549
C 4.833141 -1.309515 0.198390
C 3.940801 -2.005333 -0.835092
C 5.468488 0.011536 -0.093941
C 3.324154 -1.416132 0.451896
C 5.727631 1.045558 1.020808
C 4.013594 -3.512218 -0.923422
C 3.639242 -1.344314 -2.155285
C 2.460510 -0.215150 0.460467
C 5.598834 2.510642 0.680239
C 5.345632 0.714190 2.442976
C 0.499980 0.719850 -0.659839
C -0.868061 0.073686 -0.718726
C 0.833853 1.397122 -1.920285
C -1.976374 0.811839 -0.293751
C -1.016903 -1.237227 -1.190852
C -3.238301 0.201347 -0.365777
C -2.287915 -1.818249 -1.246472
C -3.416984 -1.105335 -0.837422
C -5.477054 0.516286 0.481245
C -5.522487 -0.552134 1.382378
C -6.620588 1.219039 0.076136
C -6.769977 -0.925979 1.890956
C -7.851138 0.827019 0.604954
C -7.928579 -0.243576 1.505227
H 5.464144 -1.958289 0.826010
H 5.247616 0.385982 -1.112364
H 2.985614 -2.124185 1.227358
H 7.320812 -0.396169 0.909632
H 4.163970 -3.995932 0.048337
H 3.091058 -3.926439 -1.352458
H 4.844803 -3.824805 -1.570856
H 2.558028 -1.362824 -2.363714
H 4.150582 -1.841533 -2.988784
H 3.946825 -0.287243 -2.181319
H 5.986365 2.736115 -0.323337
H 6.165358 3.134867 1.382405
H 4.547214 2.824455 0.717340
H 5.538210 -0.326592 2.718172
H 4.264043 0.890676 2.587538
H 5.880149 1.350287 3.158998
H 0.601523 1.428963 0.211013
H -1.892921 1.831950 0.077446
H -0.135821 -1.797671 -1.507394
H -2.400873 -2.837076 -1.619510
H -4.409443 -1.547559 -0.898112
H -4.614645 -1.065222 1.689718
H -6.532701 2.047137 -0.624036
H -6.835826 -1.753697 2.597265
H -8.757401 1.357200 0.311273
H -8.894159 -0.542872 1.907958


%chk=000184335-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184335

0 1
O 1.421608 -1.813054 -2.532787
O 2.222140 0.359773 -2.177009
O -2.295149 1.236851 0.037496
N 3.643817 0.843767 2.132875
N 0.039626 -2.709666 -5.514854
C 3.793257 -0.957753 0.229061
C 4.783750 -1.101248 -0.925591
C 3.283776 0.367549 0.716595
C 3.307091 -1.590737 -1.129113
C 2.190791 0.495711 1.773062
C 5.813834 -2.227611 -0.823518
C 5.294340 0.129049 -1.672290
C 2.327486 -0.875294 -1.966416
C 1.279911 1.715677 1.711268
C 1.543315 -0.741619 2.388853
C 0.294429 -1.200770 -3.335338
C -0.958640 -1.123205 -2.472799
C 0.153983 -2.041428 -4.534522
C -1.095279 -0.014878 -1.604660
C -1.943271 -2.140642 -2.487747
C -2.210372 0.061490 -0.745308
C -3.061940 -2.039122 -1.632133
C -3.207864 -0.942933 -0.754417
C -2.985957 1.246667 1.279803
C -2.880923 0.191604 2.215915
C -3.700065 2.425253 1.582755
C -3.521116 0.323554 3.468378
C -4.329613 2.545021 2.841465
C -4.247657 1.495143 3.786305
H 3.887963 -1.717907 1.016865
H 3.329689 1.178192 -0.015822
H 3.154780 -2.673110 -1.122934
H 4.076618 0.059030 2.665510
H 5.423990 -3.095733 -0.260993
H 6.113431 -2.579000 -1.828097
H 6.721485 -1.866429 -0.304146
H 5.739510 -0.174030 -2.638003
H 6.080542 0.628801 -1.076467
H 4.499916 0.860503 -1.885924
H 1.827167 2.586208 1.312236
H 0.914057 1.980424 2.721182
H 0.401693 1.525547 1.066509
H 2.213059 -1.619883 2.400408
H 0.634090 -1.020743 1.823114
H 1.238990 -0.533183 3.432194
H 0.625283 -0.183409 -3.624783
H -0.345549 0.782767 -1.582636
H -1.841346 -2.995512 -3.164489
H -3.834280 -2.815242 -1.650809
H -4.082897 -0.862244 -0.102796
H -2.304173 -0.707946 1.977202
H -3.747387 3.224591 0.837354
H -3.442332 -0.488816 4.199256
H -4.884965 3.458133 3.081539
H -4.738749 1.590844 4.760297


