%chk=000201705.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201705

0 1
O 5.633465 1.998865 0.625064
N -0.621734 -0.522558 0.527852
C 1.802032 -1.071360 -0.041087
C 1.951599 -1.742471 1.366557
C 0.311205 -1.123141 -0.480276
C 0.975370 -1.064864 2.346922
C 2.618166 -1.856717 -1.107989
C -0.479922 -1.165441 1.873121
C 2.372392 0.347074 0.060090
C 1.743951 -3.260862 1.345820
C -2.038084 -0.608505 0.037847
C 2.695554 -1.147360 -2.467326
C 3.752940 0.495341 0.303185
C 1.586756 1.498016 -0.078217
C -2.874541 0.479373 0.740182
C 3.426118 -1.998751 -3.503255
C 4.292515 1.781611 0.391444
C 2.154475 2.775881 0.014501
C -4.262710 0.526066 0.165940
C 3.516635 2.942858 0.248439
C -4.547304 1.358129 -0.928140
C -5.282372 -0.267774 0.713768
C -5.837264 1.396836 -1.463409
C -6.570859 -0.225384 0.174625
C -6.851739 0.606129 -0.914073
H 2.991601 -1.553705 1.734366
H 0.194787 -0.546338 -1.425877
H 0.051070 -2.179152 -0.714778
H 1.251934 0.005632 2.454688
H 1.070836 -1.510140 3.353335
H 2.176614 -2.862455 -1.245767
H 3.642957 -2.035204 -0.729807
H -0.813647 -2.225500 1.883295
H -1.139168 -0.612088 2.578363
H 2.547499 -3.774314 0.808031
H 1.728497 -3.666466 2.364180
H 0.796127 -3.539935 0.872900
H -2.057635 -0.424590 -1.059097
H -2.499638 -1.606075 0.197301
H 3.210657 -0.171065 -2.355339
H 1.677680 -0.906057 -2.831447
H 4.390064 -0.375443 0.412288
H 0.509100 1.416184 -0.232701
H -2.364415 1.460619 0.633811
H -2.904817 0.296398 1.832979
H 4.451753 -2.224512 -3.190463
H 2.917538 -2.953363 -3.677100
H 3.486575 -1.479575 -4.466811
H 1.516942 3.653496 -0.096233
H 3.979622 3.921548 0.323373
H -3.761950 1.975522 -1.359690
H -5.070895 -0.916730 1.560587
H 6.135380 1.154891 0.714825
H -6.052884 2.045662 -2.310680
H -7.358476 -0.841672 0.604731
H -7.855352 0.638635 -1.331450


%chk=000201705-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201705

0 1
O 5.757388 2.019767 0.523387
N -0.624464 -0.497177 0.580762
C 1.807417 -1.055162 -0.027091
C 1.963911 -1.730956 1.396741
C 0.301225 -1.073755 -0.427849
C 0.990906 -1.042432 2.389839
C 2.590619 -1.878608 -1.109233
C -0.472777 -1.120936 1.916727
C 2.395978 0.379195 0.040732
C 1.783448 -3.270566 1.406891
C -2.020271 -0.503963 0.085119
C 2.622894 -1.272241 -2.532308
C 3.791231 0.541006 0.263057
C 1.612245 1.548978 -0.125975
C -2.971282 0.409789 0.905389
C 3.488658 -2.113847 -3.495411
C 4.376561 1.825876 0.308042
C 2.209143 2.831517 -0.084388
C -4.342241 0.507009 0.253139
C 3.592541 2.987285 0.131250
C -4.642182 1.553886 -0.656651
C -5.337269 -0.473749 0.503385
C -5.899772 1.621542 -1.298170
C -6.596085 -0.411851 -0.136004
C -6.881883 0.637040 -1.040815
H 2.996806 -1.524340 1.744517
H 0.165389 -0.501514 -1.364531
H 0.026365 -2.135433 -0.663050
H 1.266505 0.022807 2.498573
H 1.077156 -1.516109 3.387026
H 2.148323 -2.892313 -1.171360
H 3.635742 -2.023440 -0.765525
H -0.821010 -2.187772 1.906858
H -1.114735 -0.581484 2.635720
H 2.595166 -3.783300 0.862338
H 1.800325 -3.638776 2.450154
H 0.824596 -3.589483 0.960216
H -2.010281 -0.140172 -0.960552
H -2.446722 -1.541410 0.058985
H 3.014262 -0.238481 -2.488773
H 1.594863 -1.203159 -2.939130
H 4.434450 -0.341088 0.390925
H 0.529691 1.453523 -0.236378
H -2.499109 1.406761 0.981973
H -3.075251 0.014078 1.932980
H 4.537568 -2.162454 -3.145463
H 3.112030 -3.152012 -3.569285
H 3.493473 -1.683222 -4.513484
H 1.584372 3.722664 -0.214163
H 4.070859 3.970286 0.168696
H -3.886521 2.323865 -0.857595
H -5.125490 -1.286106 1.210364
H 6.217382 1.151231 0.637567
H -6.114987 2.441416 -1.993112
H -7.353555 -1.176042 0.073300
H -7.858603 0.689035 -1.534958


