%chk=000202032.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202032

1 1
O -0.426311 -1.604278 0.073311
N -2.619173 0.490825 0.155866
C -3.634617 0.051659 -0.908526
C -3.025035 1.869050 0.701576
C -1.198383 0.597919 -0.477367
C -2.615813 -0.541008 1.302138
C -5.076419 0.065206 -0.393427
C -4.460990 1.892038 1.230099
C -5.462621 1.435362 0.167491
C -0.708405 -0.744054 -1.057431
C -1.130690 1.662632 -1.563960
C -1.649594 -0.205086 2.422909
C 0.782921 -2.319718 -0.028694
C 1.928992 -1.822317 0.615433
C 0.758758 -3.549861 -0.693233
C 1.914742 -0.509147 1.341014
C 3.084865 -2.617736 0.578609
C 1.923539 -4.320205 -0.709316
C 3.081901 -3.851700 -0.077723
C 2.087019 0.699999 0.459078
C 2.572881 0.602564 -0.852195
C 1.758172 1.963941 0.981063
C 2.719464 1.752184 -1.634583
C 1.909554 3.108804 0.195821
C 2.381794 3.005806 -1.117102
H -3.362217 -0.968357 -1.267503
H -3.548299 0.735916 -1.785205
H -2.311207 2.160214 1.507162
H -2.912968 2.623923 -0.115573
H -0.504177 0.883300 0.368814
H -2.352406 -1.544778 0.874721
H -3.655065 -0.621129 1.699822
H -5.235562 -0.723616 0.370646
H -5.757839 -0.208672 -1.229800
H -4.703919 2.926486 1.561061
H -4.558418 1.271817 2.145245
H -6.483856 1.392334 0.602933
H -5.529779 2.183232 -0.648737
H -1.461038 -1.272333 -1.668793
H 0.205542 -0.584721 -1.666643
H -1.587155 1.358213 -2.514544
H -0.070831 1.901063 -1.789224
H -1.582318 2.622871 -1.273248
H -0.588972 -0.325857 2.111057
H -1.781582 0.798777 2.842082
H -1.787299 -0.912536 3.259644
H -0.153794 -3.900263 -1.170106
H 2.714689 -0.493391 2.119516
H 0.953492 -0.429857 1.913530
H 3.996927 -2.268813 1.067114
H 1.929831 -5.288131 -1.213374
H 3.990728 -4.456819 -0.095119
H 2.868104 -0.365838 -1.257980
H 1.422579 2.060387 2.011574
H 3.116628 1.670558 -2.647560
H 1.676622 4.088889 0.613117
H 2.512507 3.901752 -1.723383


%chk=000202032-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202032

1 1
O -0.023123 -1.304039 0.209117
N -2.678272 0.536725 0.058200
C -3.793347 -0.037317 -0.848223
C -3.069382 1.978035 0.464720
C -1.294716 0.592076 -0.719933
C -2.547870 -0.360494 1.324732
C -5.203971 0.057290 -0.233705
C -4.447529 2.057272 1.140683
C -5.548702 1.495329 0.213231
C -0.693520 -0.801259 -0.998661
C -1.377654 1.364147 -2.054410
C -1.662509 0.201501 2.440943
C 1.032398 -2.246601 -0.014465
C 2.276990 -1.977126 0.613573
C 0.816092 -3.409517 -0.782691
C 2.499748 -0.714423 1.434418
C 3.303909 -2.939676 0.453006
C 1.862626 -4.347014 -0.933958
C 3.107877 -4.113583 -0.309932
C 2.310949 0.604353 0.680233
C 2.683284 0.738878 -0.682543
C 1.815481 1.747461 1.360073
C 2.555638 1.979696 -1.349156
C 1.687146 2.991070 0.698253
C 2.052817 3.111350 -0.663595
H -3.527280 -1.084074 -1.069715
H -3.757835 0.542804 -1.784787
H -2.259249 2.361606 1.104417
H -3.087882 2.572581 -0.462150
H -0.616520 1.122246 -0.028316
H -2.139568 -1.321187 0.976346
H -3.571638 -0.525529 1.691418
H -5.319754 -0.647663 0.609778
H -5.912527 -0.283405 -1.011341
H -4.640212 3.122236 1.365924
H -4.447753 1.531227 2.113194
H -6.525129 1.506338 0.727266
H -5.649395 2.149224 -0.675991
H -1.458524 -1.521026 -1.357708
H 0.056177 -0.683114 -1.803314
H -1.832442 0.769053 -2.865583
H -0.341743 1.598418 -2.354025
H -1.902779 2.329664 -1.988431
H -0.640222 0.416271 2.094345
H -2.089796 1.094462 2.928036
H -1.578239 -0.581601 3.215429
H -0.160415 -3.598685 -1.242658
H 3.531387 -0.743155 1.836865
H 1.829511 -0.715163 2.316055
H 4.275169 -2.759290 0.928356
H 1.700482 -5.254070 -1.525054
H 3.921355 -4.837739 -0.417483
H 3.093406 -0.126428 -1.216669
H 1.562188 1.672153 2.425933
H 2.873924 2.070792 -2.394043
H 1.329797 3.868452 1.249441
H 1.976645 4.077968 -1.173349


